trunk/chuckDissertation/dissertation.bib

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@article{Angelani98,
        Author = {L. Angelani and G. Parisi and G. Ruocco and G. Viliani},
        Date-Added = {2009-02-26 17:25:55 -0500},
        Date-Modified = {2009-02-26 17:25:55 -0500},
        Journal = prl,
        Number = 21,
        Pages = {4648-4651},
        Title = {Connected Network of Minima as a Model Glass: Long                   Time Dynamics},
        Volume = 81,
        Year = 1998}

@article{FRISCH:1984dp,
        Address = {CIRCULATION FULFILLMENT DIV, 500 SUNNYSIDE BLVD, WOODBURY, NY 11797-2999},
        Author = {Frisch, MJ and Pople, JA and Binkley, JS},
        Date = {1984},
        Date-Added = {2009-01-26 13:18:11 -0500},
        Date-Modified = {2009-01-26 13:18:40 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {3265-3269},
        Publisher = {AMER INST PHYSICS},
        Timescited = {3064},
        Title = {SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .25. SUPPLEMENTARY FUNCTIONS FOR GAUSSIAN-BASIS SETS},
        Volume = {80},
        Year = {1984}}

@article{CLARK:1983sb,
        Address = {605 THIRD AVE, NEW YORK, NY 10158-0012},
        Author = {Clark, T and Chandrasekhar, J and Spitznagel, GW and Schleyer, PV},
        Date = {1983},
        Date-Added = {2009-01-26 13:16:54 -0500},
        Date-Modified = {2009-01-26 13:17:55 -0500},
        Journal = {J. Comp. Chem.},
        Pages = {294-301},
        Publisher = {JOHN WILEY \& SONS INC},
        Timescited = {2661},
        Title = {EFFICIENT DIFFUSE FUNCTION-AUGMENTED BASIS-SETS FOR ANION CALCULATIONS .3. THE 3-21+G BASIS SET FOR 1ST-ROW ELEMENTS, LI-F},
        Volume = {4},
        Year = {1983}}

@article{KRISHNAN:1980aw,
        Address = {CIRCULATION FULFILLMENT DIV, 500 SUNNYSIDE BLVD, WOODBURY, NY 11797-2999},
        Author = {Krishnan, R and Binkley JS and Seeger, R and Pople, JA},
        Date = {1980},
        Date-Added = {2009-01-26 13:15:54 -0500},
        Date-Modified = {2009-01-26 13:16:35 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {650-654},
        Publisher = {AMER INST PHYSICS},
        Timescited = {4333},
        Title = {SELF-CONSISTENT MOLECULAR-ORBITAL METHODS .20. BASIS SET FOR CORRELATED WAVE-FUNCTIONS},
        Volume = {72},
        Year = {1980}}

@article{MCLEAN:1980xi,
        Address = {CIRCULATION FULFILLMENT DIV, 500 SUNNYSIDE BLVD, WOODBURY, NY 11797-2999},
        Author = {Mclean, AD and Chandler, GS},
        Date = {1980},
        Date-Added = {2009-01-26 13:15:20 -0500},
        Date-Modified = {2009-01-26 13:15:41 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {5639-5648},
        Publisher = {AMER INST PHYSICS},
        Timescited = {2663},
        Title = {CONTRACTED GAUSSIAN-BASIS SETS FOR MOLECULAR CALCULATIONS .1. 2ND ROW ATOMS, Z=11-18},
        Volume = {72},
        Year = {1980}}

@misc{LACV3P,
        Date-Added = {2009-01-26 13:15:05 -0500},
        Date-Modified = {2009-01-26 13:26:04 -0500},
        Title = {The LACV3P basis set is a triple-zeta contraction of the LACVP basis set developed and tested at Schr{\"o}dinger, Inc.}}

@article{HAY:1985xt,
        Address = {CIRCULATION FULFILLMENT DIV, 500 SUNNYSIDE BLVD, WOODBURY, NY 11797-2999},
        Author = {Hay, PJ and Wadt, WR},
        Date = {1985},
        Date-Added = {2009-01-26 13:14:01 -0500},
        Date-Modified = {2009-01-26 13:14:28 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {299-310},
        Publisher = {AMER INST PHYSICS},
        Timescited = {4751},
        Title = {ABINITIO EFFECTIVE CORE POTENTIALS FOR MOLECULAR CALCULATIONS - POTENTIALS FOR K TO AU INCLUDING THE OUTERMOST CORE ORBITALS},
        Volume = {82},
        Year = {1985}}

@inbook{Perdew1991,
        Address = {Berlin},
        Author = {Perdew, J. P.},
        Date-Added = {2009-01-26 13:11:51 -0500},
        Date-Modified = {2009-01-26 13:11:51 -0500},
        Editor = {P. Ziesche and H. Eschrig},
        Pages = {11},
        Publisher = {Akademie Verlag},
        Series = {Electronic Structure of Solids},
        Title = {Unified Theory of Exchange and Correlation Beyond the Local Density Approximation},
        Year = {1991}}

@misc{PERDEW:1992xi,
        Abstract = {Generalized gradient approximations (GGA's) seek to improve upon the accuracy of the local-spin-density (LSD) approximation in electronic-structure calculations. Perdew and Wang have developed a GGA based on real-space cutoff of the spurious long-range components of the second-order gradient expansion for the exchange-correlation hole. We have found that this density functional performs well in numerical tests for a variety of systems: (1) Total energies of 30 atoms are highly accurate. (2) Ionization energies and electron affinities are improved in a statistical sense, although significant interconfigurational and interterm errors remain. (3) Accurate atomization energies are found for seven hydrocarbon molecules, with a rms error per bond of 0.1 eV, compared with 0.7 eV for the LSD approximation and 2.4 eV for the Hartree-Fock approximation. (4) For atoms and molecules, there is a cancellation of error between density functionals for exchange and correlation, which is most striking whenever the Hartree-Fock result is furthest from experiment. (5) The surprising LSD underestimation of the lattice constants of Li and Na by 3-4 \% is corrected, and the magnetic ground state of solid Fe is restored. (6) The work function, surface energy (neglecting the long-range contribution), and curvature energy of a metallic surface are all slightly reduced in comparison with LSD. Taking account of the positive long-range contribution, we find surface and curvature energies in good agreement with experimental or exact values. Finally, a way is found to visualize and understand the nonlocality of exchange and correlation, its origins, and its physical effects.},
        Address = {ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA},
        Author = {Perdew, JP and Chevary, JA and Vosko, SH and Jackson, KA and Pederson MR and Singh, DJ and Fiolhais, C},
        Date = {SEP 15 1992},
        Date-Added = {2009-01-26 13:11:51 -0500},
        Date-Modified = {2009-01-26 13:13:37 -0500},
        Note = {Physical Review B},
        Pages = {6671-6687},
        Publisher = {AMERICAN PHYSICAL SOC},
        Timescited = {5630},
        Title = {ATOMS, MOLECULES, SOLIDS, AND SURFACES - APPLICATIONS OF THE GENERALIZED GRADIENT APPROXIMATION FOR EXCHANGE AND CORRELATION},
        Volume = {46},
        Year = {1992}}

@book{Slater,
        Address = {New York},
        Author = {Slater, J. C.},
        Date-Added = {2009-01-26 13:11:09 -0500},
        Date-Modified = {2009-01-26 13:11:09 -0500},
        Publisher = {McGraw-Hill},
        Title = {Quantum Theory of Molecules and Solids Vol. 4: The Self-Consistent Field for Molecules and Solids},
        Year = {1974}}

@article{PhysRevB.13.5188,
        Author = {Monkhorst, Hendrik J. and Pack, James D.},
        Date-Added = {2009-01-26 13:08:59 -0500},
        Date-Modified = {2009-01-26 13:10:47 -0500},
        Journal = {Phys. Rev. B},
        Month = {Jun},
        Number = {12},
        Numpages = {4},
        Pages = {5188--5192},
        Publisher = {American Physical Society},
        Title = {Special points for Brillouin-zone integrations},
        Volume = {13},
        Year = {1976},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.13.5188}}

@article{PhysRevB.45.13244,
        Author = {Perdew, John P. and Wang, Yue },
        Date-Added = {2009-01-26 13:08:50 -0500},
        Date-Modified = {2009-01-26 13:09:47 -0500},
        Journal = {Phys. Rev. B},
        Month = {Jun},
        Number = {23},
        Numpages = {5},
        Pages = {13244--13249},
        Publisher = {American Physical Society},
        Title = {Accurate and simple analytic representation of the electron-gas correlation energy},
        Volume = {45},
        Year = {1992},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.45.13244}}

@article{PhysRevB.46.6671,
        Author = {Perdew, John P. and Chevary, J. A. and Vosko, S. H. and Jackson, Koblar A. and Pederson, Mark R. and Singh, D. J. and Fiolhais, Carlos },
        Date-Added = {2009-01-26 13:08:50 -0500},
        Date-Modified = {2009-01-26 13:10:00 -0500},
        Journal = {Phys. Rev. B},
        Month = {Sep},
        Number = {11},
        Numpages = {16},
        Pages = {6671--6687},
        Publisher = {American Physical Society},
        Title = {Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation},
        Volume = {46},
        Year = {1992},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.46.6671}}

@article{PhysRevB.59.1758,
        Author = {Kresse, G.  and Joubert, D. },
        Date-Added = {2009-01-26 13:08:33 -0500},
        Date-Modified = {2009-01-26 13:10:15 -0500},
        Journal = {Phys. Rev. B},
        Month = {Jan},
        Number = {3},
        Numpages = {17},
        Pages = {1758--1775},
        Publisher = {American Physical Society},
        Title = {From ultrasoft pseudopotentials to the projector augmented-wave method},
        Volume = {59},
        Year = {1999},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.59.1758}}

@article{PhysRevB.50.17953,
        Author = {Bl\"ochl, P. E.},
        Date-Added = {2009-01-26 13:08:33 -0500},
        Date-Modified = {2009-01-26 13:10:29 -0500},
        Journal = {Phys. Rev. B},
        Month = {Dec},
        Number = {24},
        Numpages = {26},
        Pages = {17953--17979},
        Publisher = {American Physical Society},
        Title = {Projector augmented-wave method},
        Volume = {50},
        Year = {1994},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.50.17953}}

@article{Kresse:1996zm,
        Author = {Kresse, G. and Furthm{\"u}ller, J.},
        Date-Added = {2009-01-26 13:07:52 -0500},
        Date-Modified = {2009-01-26 13:07:52 -0500},
        Journal = {Computational Materials Science},
        Number = {1},
        Pages = {15--50},
        Title = {Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set},
        Ty = {JOUR},
        Volume = {6},
        Year = {1996},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TWM-3VRVTBF-3/1/4a2d93f8bf028203df942b4b603e16e3}}

@article{liu96:new_model,
        Author = {Y. Liu and T. Ichiye},
        Date-Added = {2009-01-25 12:07:41 -0500},
        Date-Modified = {2009-01-25 21:53:35 -0500},
        Journal = {J. Phys. Chem.},
        Pages = {2723-2730},
        Title = {Soft sticky dipole potential for liquid water: a new model},
        Volume = 100,
        Year = 1996}

@article{Bratko85,
        Author = {D. Bratko and L. Blum and A. Luzar},
        Date-Added = {2009-01-25 12:07:27 -0500},
        Date-Modified = {2009-01-25 21:54:07 -0500},
        Journal = {J. Chem. Phys.},
        Number = 12,
        Pages = {6367-6370},
        Title = {A simple model for the intermolecular potential of water},
        Volume = 83,
        Year = 1985}

@article{Bratko95,
        Author = {L. Blum and F. Vericat and D. Bratko},
        Date-Added = {2009-01-25 12:07:27 -0500},
        Date-Modified = {2009-01-25 21:54:26 -0500},
        Journal = {J. Phys. Chem.},
        Number = 3,
        Pages = {1461-1462},
        Title = {Towards an analytical model of water: The octupolar model},
        Volume = 102,
        Year = 1995}

@article{fennell04,
        Author = {C.~J. Fennell and J.~D. Gezelter},
        Date-Added = {2009-01-25 12:06:44 -0500},
        Date-Modified = {2009-01-25 21:55:09 -0500},
        Journal = {J. Chem. Phys.},
        Number = 19,
        Pages = {9175-9184},
        Title = {On the structural and transport properties of the soft sticky dipole(SSD) and related single point water models},
        Volume = 120,
        Year = 2004}

@article{Mori1996244,
        Author = {H. Mori and H. Yasuda},
        Date-Added = {2009-01-25 11:40:54 -0500},
        Date-Modified = {2009-01-25 21:14:54 -0500},
        Doi = {DOI: 10.1016/S0921-5093(96)10297-5},
        Issn = {0921-5093},
        Journal = {Mat. Sci. Eng. A},
        Keywords = {Au-Sb alloy},
        Note = {International Conference on Nano-Clusters and Granular Materials},
        Pages = {244 - 248},
        Title = {Effect of cluster size on phase stability in nm-sized {A}u-{S}b alloy clusters},
        Url = {http://www.sciencedirect.com/science/article/B6TXD-3VSGYDF-22/2/84c6748cfde7267856d794a9539fe476},
        Volume = {217-218},
        Year = {1996},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TXD-3VSGYDF-22/2/84c6748cfde7267856d794a9539fe476},
        Bdsk-Url-2 = {http://dx.doi.org/10.1016/S0921-5093(96)10297-5}}

@article{Schmid:2000ul,
        Abstract = {We have studied the formation kinetics of the copper-tin alloy bronze when tin is deposited on the (111) surface of copper at room temperature. Low-energy electron microscopy and atomic-resolution scanning tunneling microscopy reveal that bronze forms on the surface by a complicated, unanticipated cooperative mechanism: Ordered two-dimensional tin islands containing several hundred thousand atoms spontaneously sweep across the surface, leaving bronze alloys in their tracks. We propose that this process, driven by surface free energy, is a version of the "camphor dance" observed on liquid surfaces, and should be a general mechanism of surface alloying when surface diffusion is faster than exchange into the substrate.},
        Author = {Schmid, A. K. and Bartelt, N. C. and Hwang, R. Q.},
        Copyright = {Copyright {\^A}{\copyright} 2000 American Association for the Advancement of Science},
        Date-Added = {2009-01-25 11:36:28 -0500},
        Date-Modified = {2009-01-25 11:36:46 -0500},
        Issn = {00368075},
        Journal = {Science},
        Jstor_Articletype = {primary_article},
        Jstor_Formatteddate = {Nov. 24, 2000},
        Number = {5496},
        Pages = {1561--1564},
        Publisher = {American Association for the Advancement of Science},
        Series = {New Series},
        Title = {Alloying at Surfaces by the Migration of Reactive Two-Dimensional Islands},
        Url = {http://www.jstor.org/stable/3078351},
        Volume = {290},
        Year = {2000},
        Bdsk-Url-1 = {http://www.jstor.org/stable/3078351}}

@article{Meng:2004p151,
        Abstract = {We present a density functional theory study of water adsorption on metal surfaces. Prototype water structures including monomers, clusters, one-dimensional chains, and overlayers have been investigated in detail on a model system-a Pt(111) surface. The structure, energetics, and vibrational spectra are all obtained and compared with available experimental data. This study is further extended to other metal surfaces including Ru(0001), Rh(111), Pd(111), and Au(111), where adsorption of monomers and bilayers has been investigated. From these studies, a general picture has emerged regarding the water-surface interaction, the interwater hydrogen bonding, and the wetting order of the metal surfaces. The water-surface interaction is dominated by the lone pair-d band coupling through the surface states. It is rather localized in the contacting layer. A simultaneous enhancement of hydrogen bonding is generally observed in many adsorbed structures. Some special issues such as the partial dissociation of water on Ru(0001) and in the RT39 bilayer phase, the H-up and H-down conversion, and the quantum-mechanical motions of H atoms are also discussed.},
        Affiliation = {Chinese Acad Sci, Inst Phys, Beijing 100080, Peoples R China},
        Author = {S Meng and EG Wang and SW Gao},
        Date-Added = {2009-01-23 13:37:00 -0500},
        Date-Modified = {2009-01-25 21:52:55 -0500},
        Doi = {10.1103/PhysRevB.69.195404},
        Journal = {Phys. Rev. B},
        Keywords = {Hydrogen-Bonded Systems, Clusters, H2O, Molecular-Dynamics Simulations, Vibrational-Spectra, Pt(111) Surface, Ice Films, Wave Basis-Set, Partial Dissociation, Energy Electron-Diffraction},
        Language = {English},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/2004/Meng/Phys%20Rev%20B%202004%20Meng-2.pdf},
        Month = {Jan},
        Pages = {195404},
        Pmid = {000221961700068},
        Rating = {0},
        Read = {Yes},
        Title = {Water adsorption on metal surfaces: A general picture from density functional theory studies},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p151},
        Url = {http://prola.aps.org/abstract/PRB/v69/i19/e195404},
        Volume = {69},
        Year = {2004},
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        Bdsk-Url-1 = {http://prola.aps.org/abstract/PRB/v69/i19/e195404},
        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.69.195404}}

@article{Meng:2003p289,
        Abstract = {A molecular picture of hydrophilic and hydrophobic interactions, which ubiquitously exist in nature, has been proposed based on ab initio density functional study of water at two prototype metal (Pt and Au) surfaces. We demonstrate that the hydrophilicity-hydrophobicity can be characterized by the water-surface coupling and the strength of the hydrogen bond at the interfaces. From this picture, Pt is found to be hydrophilic while Au is hydrophobic, in agreement with experiment. The effect of the charge transfer and the long-ranged electron polarization of water on these interactions are also elaborated.(C) 2003 American Institute of Physics.},
        Affiliation = {Chalmers Univ Technol, Dept Appl Phys, SE-41296 Gothenburg, Sweden},
        Author = {S Meng and EG Wang and SW Gao},
        Date-Added = {2009-01-23 13:37:00 -0500},
        Date-Modified = {2009-01-25 21:52:45 -0500},
        Doi = {10.1063/1.1617974},
        Journal = {J. Chem. Phys.},
        Keywords = {Kinetics, Dynamics, Adsorption, Surfaces, Water, Pt(111), Ice Films, Simulation},
        Language = {English},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/2003/Meng/J%20Chem%20Phys%202003%20Meng.pdf},
        Month = {Jan},
        Pages = {7617--7620},
        Pmid = {000185703100001},
        Rating = {0},
        Read = {Yes},
        Title = {A molecular picture of hydrophilic and hydrophobic interactions from ab initio density functional theory calculations},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p289},
        Url = {http://scitation.aip.org/getabs/servlet/GetabsServlet?prog=normal&id=JCPSA6000119000015007617000001&idtype=cvips&gifs=yes},
        Volume = {119},
        Year = {2003},
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        Bdsk-Url-1 = {http://scitation.aip.org/getabs/servlet/GetabsServlet?prog=normal&id=JCPSA6000119000015007617000001&idtype=cvips&gifs=yes},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1617974}}

@article{Hodak:2000ek,
        Author = {Hodak, Jose H. and Henglein, Arnim and Hartland, Gregory V.},
        Date-Added = {2009-01-21 10:16:12 -0500},
        Date-Modified = {2009-01-25 21:33:59 -0500},
        Doi = {10.1021/jp000578v},
        Eprint = {http://pubs.acs.org/doi/pdf/10.1021/jp000578v},
        Journal = {J. Phys. Chem. B},
        Number = {21},
        Pages = {5053-5055},
        Title = {Coherent Excitation of Acoustic Breathing Modes in Bimetallic Core&#x2212;Shell Nanoparticles},
        Url = {http://pubs.acs.org/doi/abs/10.1021/jp000578v},
        Volume = {104},
        Year = {2000},
        Bdsk-Url-1 = {http://pubs.acs.org/doi/abs/10.1021/jp000578v},
        Bdsk-Url-2 = {http://dx.doi.org/10.1021/jp000578v}}

@article{Chen:1997p2142,
        Abstract = {The kinetics of a first-order, solid-solid phase transition were investigated in the prototypical nanocrystal system CdSe as a function of crystallite size. In contrast to extended solids, nanocrystals convert from one structure to another by single nucleation events, and the transformations obey simple unimolecular kinetics. Barrier heights were observed to increase with increasing nanocrystal size, although they also depend on the nature of the nanocrystal surface. These results are analogous to magnetic phase transitions in nanocrystals and suggest general rules that may be of use in the discovery of new metastable phases.},
        Affiliation = {UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720},
        Author = {CC Chen and AB Herhold and CS Johnson and AP Alivisatos},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-02-27 16:13:26 -0500},
        Journal = {Science},
        Keywords = {Nitride, Wurtzite, Rock-Salt Phase, Gap, High-Pressure Phase, Transformation, Transition, Cdse Nanocrystals, Surface},
        Language = {English},
        Month = {Jan},
        Number = {5311},
        Pages = {398--401},
        Pmid = {A1997WU47700034},
        Rating = {0},
        Title = {Size dependence of structural metastability in semiconductor nanocrystals},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2142},
        Volume = {276},
        Year = {1997}}

@article{Das:1999p2397,
        Affiliation = {Indian Inst Technol, Dept Mat {\&} Met Engn, Kharagpur 721302, W Bengal, India},
        Author = {D Das and PP Chatterjee and I Manna and SK Pabi},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-20 19:14:00 -0500},
        Journal = {Scripta Mater},
        Keywords = {Solid-State Reaction, Mechanical Alloying, Stability, Ni, Mathematical Modeling, Kinetics, Diffusion, X-Ray Diffraction, Sharp Concentration Gradients},
        Language = {English},
        Month = {Jan},
        Number = {8},
        Pages = {861--866},
        Pmid = {000082838300012},
        Rating = {0},
        Title = {A measure of enhanced diffusion kinetics in mechanical alloying of Cu-18 at.% Al by planetary ball milling},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2397},
        Volume = {41},
        Year = {1999}}

@article{Frenkel:2000p2400,
        Abstract = {X-ray-absorption fine structure (XAFS) and x-ray-diffraction (XRD) measurements of disordered alloys AuxCu1-x, and Au0.5Ag0.5 prepared by melt spinning were performed. In the Au0.5Ag0.5 alloy, no significant local deviations of the atoms from the average fee lattice were detected while in AuxCu1-x, allays, significant deviations of atoms from the average fee lattice were found. Mean-square Vibrations of the Cu-Cu distances revealed by the XAFS in AuxCu1-x alloys indicate the weakening of contact between Cu atoms in the dilute limit. Our computer simulation for AuxCu1-x clusters of 10(5) atoms reproduces the main features of both the XAFS and XRD data.},
        Affiliation = {Univ Illinois, Mat Res Lab, Urbana, IL 61801 USA},
        Author = {AI Frenkel and VS Machavariani and A Rubshtein and Y Rosenberg and A Voronel and EA Stern},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:29:07 -0500},
        Journal = {Phys. Rev. B},
        Keywords = {First-Principles, Bond Lengths, Mismatch, Absorption Fine-Structure, Mixed Salts, Ga1-Xinxas, Distortions, Crystalline, Films, Strained-Semiconductor Alloys},
        Language = {English},
        Month = {Jan},
        Number = {14},
        Pages = {9364--9371},
        Pmid = {000089830500027},
        Rating = {0},
        Title = {Local structure of disordered Au-Cu and Au-Ag alloys},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2400},
        Volume = {62},
        Year = {2000}}

@article{GOLDSTEIN:1992p2138,
        Abstract = {New physics occurs in semiconductors when one or more dimensions of the crystal are reduced to a size comparable to bulk electron delocalization lengths (tens to hundreds of angstroms). The properties of "quantum dots" or semiconductor nanocrystals are now being studied, as techniques to fabricate the crystallites are developed. Temperature-dependent electron diffraction studies on nanocrystals of CdS show a large depression in the melting temperature with decreasing size, as a larger fraction of the total number of atoms is on the surface. Thermal stability may play a role in determining the uses of semiconductor nanocrystals.},
        Affiliation = {UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720},
        Author = {AN Goldstein and CM Echer and AP Alivisatos},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-21 09:43:39 -0500},
        Journal = {Science},
        Keywords = {Gold, Molecular-Dynamics, Size, Small Particles, Clusters},
        Language = {English},
        Month = {Jan},
        Number = {5062},
        Pages = {1425--1427},
        Pmid = {A1992HX33700028},
        Rating = {0},
        Title = {Melting in Semiconductor Nanocrystals},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2138},
        Volume = {256},
        Year = {1992}}

@article{HAASE:1992p2139,
        Abstract = {CdS crystallites of 4-nm diameter have been studied under high pressure up to 10 GPa by optical absorption and Raman scattering. The solid-solid phase transition from the zinc blende to the rock salt phase is observed at pressures far in excess of the bulk phase transition pressure of 3 GPa. The pressure of the phase transition depends on the nature of the moiety used to derivatize the surface. In addition, because the compression of the lattice with pressure is the same as in the bulk crystal, it is possible to observe the dependence of the zinc blende crystallite properties up to pressures far higher than in the bulk. The elevated phase transition pressure and its dependence on the surface stabilizer can be explained by a higher value of the surface tension for the rock salt phase nanocrystals compared to the zinc blende.},
        Affiliation = {UNIV CALIF BERKELEY,DEPT CHEM,BERKELEY,CA 94720},
        Author = {M Haase and AP Alivisatos},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-21 09:45:01 -0500},
        Journal = {Journal of Physical Chemistry},
        Keywords = {Crystallites, Particles, Electronic-Spectra, Hydrostatic-Pressure, Redox Potentials, Aqueous-Solution, Resonance Raman-Spectra, Semiconductor Clusters, Temperature, High-Pressure},
        Language = {English},
        Month = {Jan},
        Number = {16},
        Pages = {6756--6762},
        Pmid = {A1992JH64000042},
        Rating = {0},
        Title = {Arrested Solid-Solid Phase-Transition in 4-Nm-Diameter Cds Nanocrystals},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2139},
        Volume = {96},
        Year = {1992}}

@article{HENGLEIN:1999p2419,
        Abstract = {Orange- or yellow-orange-colored aqueous dispersions of ultrafine gold particles (similar to 2 nm) result from the gamma-irradiation of deaerated solutions containing hydrolyzed AuCl4- and poly(vinyl alcohol) or poly(vinylpyrrolidone), respectively. The particles have a weak and very broad plasmon absorption band with maximum in the 490 to 500 nm range, i.e., at substantially shorter wavelengths than expected from classical Mie theory using bulk dielectric data; moreover, the specific UV absorption increases as the particles become smaller. The particles are used as seeds in the radiolytic reduction of added Au(CN)(2)(-) to yield larger particles of any desired size and improved monodispersity. The particles partially react with oxygen. Chemisorption of S-mercapto propionic acid strongly affects the electronics of the particles, as indicated by the changes in optical absorption. The early stages of AuCl4- reduction are also investigated. The reduction occurs essentially in two steps: (1) formation, and (2) reduction of Au+. A 203-nm absorption band is tentatively attributed to Au+. Without further irradiation, Au+ disappears thermally within hours to yield larger particles (20-70 nm).},
        Affiliation = {Univ Notre Dame, Notre Dame Radiat Lab, Notre Dame, IN 46556 USA},
        Author = {A Henglein},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-21 09:45:18 -0500},
        Journal = {Langmuir},
        Keywords = {Clusters},
        Language = {English},
        Month = {Jan},
        Number = {20},
        Pages = {6738--6744},
        Pmid = {000082933300021},
        Rating = {0},
        Title = {Radiolytic preparation of ultrafine colloidal gold particles in aqueous solution: Optical spectrum, controlled growth, and some chemical reactions},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2419},
        Volume = {15},
        Year = {1999}}

@article{JOHNSON:1989p2479,
        Author = {RA Johnson},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-21 09:45:46 -0500},
        Journal = {Phys Rev B},
        Language = {English},
        Month = {Jan},
        Number = {17},
        Pages = {12554--12559},
        Pmid = {A1989AB03200011},
        Rating = {0},
        Title = {Alloy Models with the Embedded-Atom Method},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2479},
        Volume = {39},
        Year = {1989}}

@letter{Link:1999p2468,
        Abstract = {Gold-silver alloy nanoparticles with varying mole fractions are prepared in aqueous solution by the co-reduction of chlorauric acid HAuCl4 and silver nitrate AgNO3 with sodium citrate. As the optical absorption spectra of their solutions show only one plasmon absorption it is concluded that mixing of gold and silver leads to a homogeneous formation of alloy nanoparticles. The maximum of the plasmon band blue-shifts linearly with increasing silver content. This fact cannot be explained by a simple linear combination of the dielectric constants of gold and silver within the Mie theory. On the other hand, the extinction coefficient is found to decrease exponentially rather than linearly with increasing gold mole fraction x(Au). Furthermore, the size distribution of the alloy nanoparticles is examined using transmission electron microscopy (TEM). High-resolution TEM (HRTEM) also confirms the formation of homogeneous gold-silver alloy nanocrystals.},
        Affiliation = {Georgia Inst Technol, Sch Chem {\&} Biochem, Laser Dynam Lab, Atlanta, GA 30332 USA},
        Author = {S Link and ZL Wang and MA El-Sayed},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:30:56 -0500},
        Journal = {J. Phys. Chem. B},
        Keywords = {Structural-Analysis, Particles, Metal, Optical-Absorption, Chemistry, Colloids, Crystals, Spectrum, Bimetallic Clusters},
        Language = {English},
        Month = {Jan},
        Number = {18},
        Pages = {3529--3533},
        Pmid = {000080303800005},
        Rating = {0},
        Title = {Alloy formation of gold-silver nanoparticles and the dependence of the plasmon absorption on their composition},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2468},
        Volume = {103},
        Year = {1999}}

@article{MORI:1994p2372,
        Abstract = {The alloying behaviour of copper atoms into gold clusters has been studied by high-resolution electron microscopy. Preparation of nanometre-sized gold clusters and subsequent copper deposition onto the gold clusters has been carried out with the use of a miniature double-source evaporator that has been directly set at the tip of a specimen holder, Upon the deposition of copper, nanometre-sized gold clusters quickly changed into Au-Cu solid solution clusters even at ambient temperature. It has been confirmed that such spontaneous alloying takes place not via a quasimelting process but via a purely solid-state process.},
        Affiliation = {OSAKA UNIV,FAC ENGN,DEPT MAT SCI {\&} ENGN,SUITA,OSAKA 565,JAPAN},
        Author = {H Mori and H Yasuda and T Kamino},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:14:22 -0500},
        Journal = {Phil. Mag. Lett.},
        Keywords = {Small Particles, Atom Clusters},
        Language = {English},
        Month = {Jan},
        Number = {5},
        Pages = {279--283},
        Pmid = {A1994NL30400004},
        Rating = {0},
        Title = {High-Resolution Electron-Microscopy Study of Spontaneous Alloying in Gold Clusters},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2372},
        Volume = {69},
        Year = {1994}}

@article{MORI:1991p2144,
        Abstract = {A double-source evaporator which can be set in the specimen chamber of a high voltage electron microscope has been constructed. With the use of the evaporator, isolated gold clusters of 5 approximately 10 nm in size were first prepared on a supporting film of amorphous carbon, and then copper atoms were deposited onto the film (and of the deposition of copper, the gold clusters changed into highly concentrated, homogeneously mixed Au-Cu alloy clusters. The copper atom diffusivity in gold clusters deduced from the present observations is at least 9 orders of magnitude faster than the copper solute diffusion in bulk gold.},
        Author = {H Mori and M Komatsu and K Takeda and H Fujita},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:14:08 -0500},
        Journal = {Phil. Mag. Lett.},
        Keywords = {Metal Particles, Resolution},
        Language = {English},
        Month = {Jan},
        Number = {3},
        Pages = {173--178},
        Pmid = {A1991FF11900010},
        Rating = {0},
        Title = {Spontaneous Alloying of Copper into Gold Atom Clusters},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2144},
        Volume = {63},
        Year = {1991}}

@article{MULVANEY:1993p2409,
        Abstract = {Gold was deposited onto colloidal silver (mean particle size 76 angstrom) in aqueous solution, and the composite particles were studied by spectrophotometry and electron microscopy. The deposition took place via electron transfer onto the silver particles by radiolytically generated free radicals and subsequent reduction of dissolved Au(CN)2- by the stored electrons. The method allows one to control the coating thickness. The optical spectra were also calculated using Mie theory and the optical constants of the pure metals. It was found that one monolayer of gold should be sufficient to mask the silver resonance band completely and that the gold plasmon band should develop more quickly than observed. The differences between the calculated and observed spectra are explained by possible alloying of the surface layer.},
        Affiliation = {HAHN MEITNER INST BERLIN GMBH,PHOTOCHEM ABT,W-1000 BERLIN 39,GERMANY},
        Author = {P Mulvaney and M Giersig and A Henglein},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:29:55 -0500},
        Journal = {J. Phys. Chem.},
        Keywords = {Reduction, Deposition, Lead, Catalysis, Water, Organic Free-Radicals, Surface-Chemistry, Aqueous-Solution, Microelectrode},
        Language = {English},
        Month = {Jan},
        Number = {27},
        Pages = {7061--7064},
        Pmid = {A1993LV57800022},
        Rating = {0},
        Title = {Electrochemistry Of Multilayer Colloids - Preparation and Absorption-Spectrum of Gold-Coated Silver Particles},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2409},
        Volume = {97},
        Year = {1993}}

@article{Pawlow:1909p2134,
        Author = {P Pawlow},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-20 19:14:00 -0500},
        Journal = {Z Phys Chem-Stoch Ve},
        Language = {German},
        Month = {Jan},
        Number = {5},
        Pages = {545--548},
        Pmid = {000201380700002},
        Rating = {0},
        Title = {The dependency of the melting point on the surface energy of a solid body. (Supplement.)},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2134},
        Volume = {65},
        Year = {1909}}

@article{SOLLIARD:1985p2137,
        Author = {C Solliard and M Flueli},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:13:41 -0500},
        Journal = {Surf. Sci.},
        Language = {English},
        Month = {Jan},
        Number = {JUN},
        Pages = {487--494},
        Pmid = {A1985AMF8200059},
        Rating = {0},
        Title = {Surface Stress And Size Effect On the Lattice-Parameter in Small Particles of Gold and Platinum},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2137},
        Volume = {156},
        Year = {1985}}

@article{TOLBERT:1996p2141,
        Abstract = {The kinetics of solid-solid phase transitions are explored using pressure-induced structural transformations in Si nanocrystals. In agreement with the predictions of homogeneous deformation theories, large elevations in phase transition pressure are observed in nanocrystals as compared to bulk Si, and high pressure x-ray diffraction peak widths indicate an overall change in nanocrystal shape upon transformation. In addition, unlike the BC8 phase recovered in bulk Si, amorphous Si nanoclusters are obtained upon release of pressure, providing an example of kinetic size control over solid phases.},
        Affiliation = {UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT SCI,BERKELEY,CA 94720},
        Author = {SH Tolbert and AB Herhold and LE Brus and AP Alivisatos},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:13:19 -0500},
        Journal = {Phys. Rev. Lett.},
        Keywords = {Stability, Silicon, Phase-Transitions, Cds, Ge, Raman-Scattering},
        Language = {English},
        Month = {Jan},
        Number = {23},
        Pages = {4384--4387},
        Pmid = {A1996UN80000023},
        Rating = {0},
        Title = {Pressure-induced structural transformations in Si nanocrystals: Surface and shape effects},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2141},
        Volume = {76},
        Year = {1996}}

@article{YASUDA:1996p2387,
        Abstract = {The structure and phase transformation in nanometre (nm)-sized Au-Pb alloy clusters have been studied in situ by means of transmission electron microscopy, in order to see the difference in phase equilibrium between a bulk material and the corresponding nm-sized cluster. When lead (or gold) atoms are vapour-deposited on to nm-sized gold (or lead) clusters kept at ambient temperature, spontaneous dissolution of the solute atoms into the clusters takes place and homogeneous Au-Pb alloy clusters are formed. The solid solubilities of lead and of gold for the Au-Pb solid solution clusters are increased markedly as compared with those for the corresponding bulk, materials. A stable intermetallic compound formed preferentially in Pb-enriched Pb-Au alloy clusters is AuPb2, for which a heat of formation is negative. The phase transformation from Au-supersaturated Pb-Au solid solution clusters to single crystalline AuPb2 clusters takes place during a short period, and is similar to a 'martensitic' transformation.},
        Author = {H Yasuda and H Mori},
        Date-Added = {2009-01-20 19:14:00 -0500},
        Date-Modified = {2009-01-25 21:15:30 -0500},
        Journal = {Philos. Mag. A},
        Keywords = {Gold, Copper, Particles},
        Language = {English},
        Month = {Jan},
        Number = {3},
        Pages = {567--573},
        Pmid = {A1996UE04200003},
        Rating = {0},
        Title = {Phase stability and transformation in nanometre-sized Au-Pb alloy clusters produced by spontaneous alloying},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p2387},
        Volume = {73},
        Year = {1996}}

@book{Tu:1992jb,
        Address = {New York},
        Annote = {LDR    01215pam  2200277 a 4500
001    2958691
005    19920317132441.6
008    910401s1992    nyua     b    001 0 eng  
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010    $a   91003507 
020    $a0024215759
040    $aDLC$cDLC$dDLC
050 00 $aQC176.9.M84$bT83 1992
082 00 $a621.381/52$220
100 1  $aTu, K. N.$q(King-ning),$d1937-
245 10 $aElectronic thin film science :$bfor electrical engineers and materials scientists /$cKing-Ning Tu, James W. Mayer, Leonard C. Feldman ; [illustrations provided by the authors].
260    $aNew York :$bMacmillan ;$aToronto :$bMaxwell Macmillan Canada ;$aNew York :$bMaxwell Macmillan International,$cc1992.
300    $axvii, 428 p. :$bill. ;$c25 cm.
504    $aIncludes bibliographical references and index.
650  0 $aThin, films, Multilayered.
650  0 $aElectric engineering$xMaterials.
700 1  $aMayer, James W.,$d1930-
700 1  $aFeldman, Leonard C.
991    $bc-GenColl$hQC176.9.M84$iT83 1992$p00011215105$tCopy 1$wBOOKS
},
        Author = {Tu, K. N and Mayer, James W. and Feldman, Leonard C},
        Call-Number = {QC176.9.M84},
        Date-Added = {2009-01-20 19:03:26 -0500},
        Date-Modified = {2009-01-20 19:03:26 -0500},
        Dewey-Call-Number = {621.381/52},
        Genre = {Thin, films, Multilayered},
        Isbn = {0024215759},
        Library-Id = {91003507},
        Publisher = {Macmillan},
        Title = {Electronic thin film science: for electrical engineers and materials scientists},
        Year = {1992}}

@article{Kohlrausch:1863zv,
        Author = {F. Kohlrausch},
        Date-Added = {2009-01-20 18:57:41 -0500},
        Date-Modified = {2009-01-20 18:58:36 -0500},
        Journal = {Pogg. Ann. Physik},
        Pages = {352},
        Volume = {119},
        Year = {1863}}

@article{yasuda:1100,
        Author = {H. Yasuda and H. Mori and M. Komatsu and K. Takeda},
        Date-Added = {2009-01-20 16:13:52 -0500},
        Date-Modified = {2009-01-25 21:15:17 -0500},
        Doi = {10.1063/1.353272},
        Journal = {J. Appl. Phys.},
        Keywords = {GOLD; SOLID CLUSTERS; COPPER; ALLOYING EFFECTS; TRANSMISSION ELECTRON MICROSCOPY; TEMPERATURE EFFECTS; DIFFUSION},
        Number = {3},
        Pages = {1100-1103},
        Publisher = {AIP},
        Title = {Spontaneous alloying of copper atoms into gold clusters at reduced temperatures},
        Url = {http://link.aip.org/link/?JAP/73/1100/1},
        Volume = {73},
        Year = {1993},
        Bdsk-Url-1 = {http://link.aip.org/link/?JAP/73/1100/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.353272}}

@article{PhysRevLett.69.3747,
        Author = {Yasuda, H.  and Mori, H. },
        Date-Added = {2009-01-20 16:12:21 -0500},
        Date-Modified = {2009-01-20 16:12:21 -0500},
        Doi = {10.1103/PhysRevLett.69.3747},
        Journal = {Phys. Rev. Lett.},
        Month = {Dec},
        Number = {26},
        Numpages = {3},
        Pages = {3747--3750},
        Publisher = {American Physical Society},
        Title = {Spontaneous alloying of zinc atoms into gold clusters and formation of compound clusters},
        Volume = {69},
        Year = {1992},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.69.3747}}

@book{Schlick:2002hc,
        Address = {New York},
        Annote = {LDR    01372cam  22002894a 4500
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100 1  $aSchlick, Tamar.
245 10 $aMolecular modeling and simulation :$ban interdisciplinary guide /$cTamar Schlick.
260    $aNew York :$bSpringer,$cc2002.
300    $axliii, 634 p. :$bill. (some col.) ;$c25 cm.
440  0 $aInterdisciplinary applied mathematics ;$vv. 21
504    $aIncludes bibliographical references (p. [561]-619) and index.
650  0 $aBiomolecules$xModels.
650  0 $aBiomolecules$xModels$xComputer simulation.
856 42 $3Publisher description$uhttp://www.loc.gov/catdir/enhancements/fy0817/2002016003-d.html
856 41 $3Table of contents only$uhttp://www.loc.gov/catdir/enhancements/fy0817/2002016003-t.html
},
        Author = {Schlick, Tamar},
        Call-Number = {QD480},
        Date-Added = {2009-01-17 10:34:37 -0500},
        Date-Modified = {2009-01-17 10:34:37 -0500},
        Dewey-Call-Number = {572/.33/015118},
        Genre = {Biomolecules},
        Isbn = {038795404X (acid-free paper)},
        Library-Id = {2002016003},
        Publisher = {Springer},
        Title = {Molecular modeling and simulation: an interdisciplinary guide},
        Url = {http://www.loc.gov/catdir/enhancements/fy0817/2002016003-d.html},
        Volume = {v. 21},
        Year = {2002},
        Bdsk-Url-1 = {http://www.loc.gov/catdir/enhancements/fy0817/2002016003-d.html}}

@book{Fox88,
        Address = {Englewood Cliffs, NJ},
        Author = {G.~C. Fox and M.~A. Johnson and G.~A Lyzenga and S.~W. Otto and J.~K. Salmon and D.~W. Walker},
        Date-Added = {2009-01-15 16:58:25 -0500},
        Date-Modified = {2009-01-15 16:58:25 -0500},
        Publisher = {Prentice-Hall},
        Title = {Solving Promblems on Concurrent Processors},
        Volume = {I},
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        Date-Modified = {2009-01-25 21:01:41 -0500},
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        Year = {1995}}

@inproceedings{Paradyn,
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        Date-Added = {2009-01-15 16:58:03 -0500},
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        Publisher = {AIP},
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@book{Frenkel1996,
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        Date-Added = {2009-01-13 17:54:11 -0500},
        Date-Modified = {2009-01-13 17:54:11 -0500},
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@article{Dullweber1997,
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@book{McQuarrie:2000yt,
        Address = {Sausalito, Calif.},
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        Author = {McQuarrie, Donald A},
        Call-Number = {QC174.8},
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        Dewey-Call-Number = {530.13},
        Genre = {Statistical mechanics},
        Isbn = {1891389157 (acid-free paper)},
        Library-Id = {00021962},
        Publisher = {University Science Books},
        Title = {Statistical mechanics},
        Year = {2000}}

@article{Verlet67,
        Author = {L. Verlet},
        Date-Added = {2009-01-13 14:16:02 -0500},
        Date-Modified = {2009-01-25 20:56:45 -0500},
        Journal = {Phys. Rev.},
        Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/TheoryTechniques/Verlet_ClassicalFluids_67.pdf},
        Number = {1},
        Pages = {98-103},
        Title = {Computer ``Experiments" on Classical Fluids. \uppercase{I. T}hermodynamic Properties of \uppercase{L}ennard-\uppercase{J}ones Molecules},
        Volume = {159},
        Year = {1967}}

@article{swope:637,
        Author = {William C. Swope and Hans C. Andersen and Peter H. Berens and Kent R. Wilson},
        Date-Added = {2009-01-13 13:53:25 -0500},
        Date-Modified = {2009-01-13 13:53:25 -0500},
        Doi = {10.1063/1.442716},
        Journal = {The Journal of Chemical Physics},
        Keywords = {COMPUTERIZED SIMULATION; EQUILIBRIUM; AGGLOMERATION; POTENTIAL ENERGY; WATER; THERMODYNAMIC PROPERTIES},
        Number = {1},
        Pages = {637-649},
        Publisher = {AIP},
        Title = {A computer simulation method for the calculation of equilibrium constants for the formation of physical clusters of molecules: Application to small water clusters},
        Url = {http://link.aip.org/link/?JCP/76/637/1},
        Volume = {76},
        Year = {1982},
        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/76/637/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.442716}}

@article{Trotter:1959rz,
        Author = {Trotter, H. F.},
        Copyright = {Copyright {\^A}{\copyright} 1959 American Mathematical Society},
        Date-Added = {2009-01-13 11:04:12 -0500},
        Date-Modified = {2009-01-13 11:04:28 -0500},
        Issn = {00029939},
        Journal = {Proceedings of the American Mathematical Society},
        Jstor_Articletype = {primary_article},
        Jstor_Formatteddate = {Aug., 1959},
        Number = {4},
        Pages = {545--551},
        Publisher = {American Mathematical Society},
        Title = {On the Product of Semi-Groups of Operators},
        Url = {http://www.jstor.org/stable/2033649},
        Volume = {10},
        Year = {1959},
        Bdsk-Url-1 = {http://www.jstor.org/stable/2033649}}

@book{Goldstein:2001uf,
        Address = {San Francisco},
        Author = {H. Goldstein and C. Poole and J. Safko},
        Date-Added = {2009-01-11 21:43:40 -0500},
        Date-Modified = {2009-01-11 21:44:00 -0500},
        Edition = {3rd},
        Publisher = {Addison Wesley},
        Title = {Classical Mechanics},
        Year = 2001}

@book{Tolman:1938kl,
        Address = {New York},
        Author = {R.~C. Tolman},
        Date-Added = {2009-01-11 21:43:20 -0500},
        Date-Modified = {2009-01-11 21:45:17 -0500},
        Publisher = {Oxford University Press, Inc.},
        Title = {The Principles of Statistical Mechanics},
        Year = {1938}}

@inbook{Voter:95,
        Author = {A.~F. Voter},
        Chapter = 4,
        Date-Added = {2009-01-11 15:12:14 -0500},
        Date-Modified = {2009-01-11 15:12:32 -0500},
        Editor = {J.~H. Westbrook and R.~L. Fleischer},
        Pages = 77,
        Publisher = {John Wiley and Sons Ltd},
        Title = {Intermetallic Compounds: Principles and Practice},
        Volume = 1,
        Year = 1995}

@article{Ercolessi02,
        Author = {U. Tartaglino and E. Tosatti and D. Passerone and F. Ercolessi},
        Date-Added = {2009-01-11 15:10:33 -0500},
        Date-Modified = {2009-01-25 20:56:10 -0500},
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        Title = {Bending strain-driven modification of surface resconstructions: Au(111)},
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@article{Ercolessi88,
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        Date-Added = {2009-01-11 15:10:33 -0500},
        Date-Modified = {2009-01-11 15:10:33 -0500},
        Journal = {Phil. Mag. A},
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        Year = 1988}

@article{Rose:1984rw,
        Author = {Rose, James H. and Smith, John R. and Guinea, Francisco  and Ferrante, John },
        Date-Added = {2009-01-11 14:11:44 -0500},
        Date-Modified = {2009-01-11 14:12:01 -0500},
        Doi = {10.1103/PhysRevB.29.2963},
        Journal = {Phys. Rev. B},
        Month = {Mar},
        Number = {6},
        Numpages = {6},
        Pages = {2963--2969},
        Publisher = {American Physical Society},
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        Volume = {29},
        Year = {1984},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.29.2963}}

@article{Hohenberg:1964bs,
        Author = {Hohenberg, P.  and Kohn, W. },
        Date-Added = {2009-01-11 12:25:26 -0500},
        Date-Modified = {2009-01-11 12:25:55 -0500},
        Doi = {10.1103/PhysRev.136.B864},
        Journal = {Phys. Rev.},
        Month = {Nov},
        Number = {3B},
        Numpages = {7},
        Pages = {B864--B871},
        Publisher = {American Physical Society},
        Title = {Inhomogeneous Electron Gas},
        Volume = {136},
        Year = {1964},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRev.136.B864}}

@article{Jacobsen:1987p1751,
        Author = {K. W Jacobsen and M. J Puska},
        Date-Added = {2009-01-11 10:53:30 -0500},
        Date-Modified = {2009-01-11 10:53:30 -0500},
        Doi = {10.1103/PhysRevB.35.7423},
        Journal = {Phys Rev B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1987/Jacobsen/Phys%20Rev%20B%201987%20Jacobsen.pdf},
        Month = {May},
        Number = {14},
        Pages = {7423--7442},
        Rating = {0},
        Read = {Yes},
        Title = {Interatomic interactions in the effective-medium theory},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1751},
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@article{Manninen:1986p1756,
        Author = {M Manninen},
        Date-Added = {2009-01-11 10:53:30 -0500},
        Date-Modified = {2009-01-11 10:53:30 -0500},
        Doi = {10.1103/PhysRevB.34.8486},
        Journal = {Phys Rev B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1986/Manninen/Phys%20Rev%20B%201986%20Manninen.pdf},
        Month = {Dec},
        Number = {12},
        Pages = {8486--8495},
        Rating = {0},
        Title = {Interatomic interactions in solids: An effective-medium approach},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1756},
        Url = {http://prola.aps.org.proxy.library.nd.edu/abstract/PRB/v34/i12/p8486_1},
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        Year = {1986},
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@article{Nrskov:1980p1752,
        Author = {J. K N{\o}rskov and N. D Lang},
        Date-Added = {2009-01-11 10:53:30 -0500},
        Date-Modified = {2009-01-25 20:49:21 -0500},
        Doi = {10.1103/PhysRevB.21.2131},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1980/N%C3%B8rskov/Phys%20Rev%20B%201980%20N%C3%B8rskov.pdf},
        Month = {Mar},
        Number = {6},
        Pages = {2131--2136},
        Rating = {0},
        Title = {Effective-medium theory of chemical binding: Application to chemisorption},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1752},
        Url = {http://prola.aps.org.proxy.library.nd.edu/abstract/PRB/v21/i6/p2131_1},
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        Year = {1980},
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@article{Nrskov:1982p1753,
        Author = {J. K N{\o}rskov},
        Date-Added = {2009-01-11 10:53:30 -0500},
        Date-Modified = {2009-01-25 20:48:45 -0500},
        Doi = {10.1103/PhysRevB.26.2875},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1982/N%C3%B8rskov/Phys%20Rev%20B%201982%20N%C3%B8rskov.pdf},
        Month = {Sep},
        Number = {6},
        Pages = {2875--2885},
        Rating = {0},
        Title = {Covalent effects in the effective-medium theory of chemical binding: Hydrogen heats of solution in the 3 d metals},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1753},
        Url = {http://prola.aps.org.proxy.library.nd.edu/abstract/PRB/v26/i6/p2875_1},
        Volume = {26},
        Year = {1982},
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        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.26.2875}}

@article{Puska:1981p1755,
        Author = {M. J Puska and M Manninen},
        Date-Added = {2009-01-11 10:53:30 -0500},
        Date-Modified = {2009-01-25 20:50:27 -0500},
        Doi = {10.1103/PhysRevB.24.3037},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1981/Puska/Phys%20Rev%20B%201981%20Puska.pdf},
        Month = {Sep},
        Number = {6},
        Pages = {3037--3047},
        Rating = {0},
        Title = {Atoms embedded in an electron gas: Immersion energies},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1755},
        Url = {http://prola.aps.org.proxy.library.nd.edu/abstract/PRB/v24/i6/p3037_1},
        Volume = {24},
        Year = {1981},
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        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.24.3037}}

@article{Stott:1980p1754,
        Author = {M. J Stott and E Zaremba},
        Date-Added = {2009-01-11 10:53:30 -0500},
        Date-Modified = {2009-01-25 20:50:01 -0500},
        Doi = {10.1103/PhysRevB.22.1564},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1980/Stott/Phys%20Rev%20B%201980%20Stott.pdf},
        Month = {Aug},
        Number = {4},
        Pages = {1564--1583},
        Rating = {0},
        Title = {Quasiatoms: An approach to atoms in nonuniform electronic systems},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1754},
        Url = {http://prola.aps.org.proxy.library.nd.edu/abstract/PRB/v22/i4/p1564_1},
        Volume = {22},
        Year = {1980},
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        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.22.1564}}

@article{BASKES:1987p1743,
        Author = {MI Baskes},
        Date-Added = {2009-01-08 18:39:57 -0500},
        Date-Modified = {2009-01-25 20:51:46 -0500},
        Journal = {Phys. Rev. Lett.},
        Language = {English},
        Month = {Jan},
        Number = {23},
        Pages = {2666--2669},
        Pmid = {A1987L084400013},
        Rating = {0},
        Title = {APPLICATION OF THE EMBEDDED-ATOM METHOD TO COVALENT MATERIALS - A SEMIEMPIRICAL POTENTIAL FOR SILICON},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1743},
        Volume = {59},
        Year = {1987}}

@article{BASKES:1989p1746,
        Author = {MI Baskes and JS Nelson and AF Wright},
        Date-Added = {2009-01-08 18:39:57 -0500},
        Date-Modified = {2009-01-25 20:52:42 -0500},
        Journal = {Phys. Rev. B},
        Language = {English},
        Month = {Jan},
        Number = {9},
        Pages = {6085--6100},
        Pmid = {A1989AT77900026},
        Rating = {0},
        Title = {SEMIEMPIRICAL MODIFIED EMBEDDED-ATOM POTENTIALS FOR SILICON AND GERMANIUM},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1746},
        Volume = {40},
        Year = {1989}}

@article{BASKES:1992p1735,
        Abstract = {In a comprehensive study, the modified embedded-atom method is extended to a variety of cubic materials and impurities. In this extension, all functions are analytic and computationally simple. The basic equations of the method are developed and applied to 26 elements: ten fcc, ten bcc, three diamond cubic, and three gaseous materials. The materials modeled include metals, semiconductors, and diatomic gases, all of which exhibit different types of bonding. Properties of these materials, including equation of state, elastic moduli, structural energies and lattice constants, simple defects, and surfaces, are calculated. The formalism for applying the method to combinations of these elements is developed and applied to the calculation of dilute heats of solution. In all cases, comparison is made to experiment or higher-level calculations when possible.},
        Author = {MI Baskes},
        Date-Added = {2009-01-08 18:39:57 -0500},
        Date-Modified = {2009-01-25 20:52:11 -0500},
        Journal = {Phys. Rev. B},
        Keywords = {Solids, X-Ray-Diffraction, Fcc Metals, Transition-Metals, Defects, Silicon, Model, Diamond, Surface-Energy Anisotropies, Self-Diffusion},
        Language = {English},
        Month = {Jan},
        Number = {5},
        Pages = {2727--2742},
        Pmid = {A1992JG57300009},
        Rating = {0},
        Title = {MODIFIED EMBEDDED-ATOM POTENTIALS FOR CUBIC MATERIALS AND IMPURITIES},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1735},
        Volume = {46},
        Year = {1992}}

@article{DAW:1989p1673,
        Author = {MS Daw},
        Date-Added = {2009-01-08 18:16:47 -0500},
        Date-Modified = {2009-01-25 20:50:55 -0500},
        Journal = {Phys. Rev. B},
        Language = {English},
        Month = {Jan},
        Number = {11},
        Pages = {7441--7452},
        Pmid = {A1989U160600005},
        Rating = {0},
        Title = {MODEL OF METALLIC COHESION - THE EMBEDDED-ATOM METHOD},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1673},
        Volume = {39},
        Year = {1989}}

@article{DAW:1983ht,
        Address = {ONE PHYSICS ELLIPSE, COLLEGE PK, MD 20740-3844 USA},
        Author = {Daw, MS and Baskes, MI},
        Date = {1983},
        Date-Added = {2009-01-08 16:53:15 -0500},
        Date-Modified = {2009-01-25 20:40:38 -0500},
        Isi = {A1983QL86700017},
        Isi-Recid = {48773580},
        Isi-Ref-Recids = {13168554 38608062 48773581 23 24 27591671 8875093 28564931 40375597 13708004 22084000 46774049 48773582 35461841 47020808 47340067 44136739 23497752 18554880 20842010 35247938 40834326 48773583},
        Journal = {Phys. Rev. Lett.},
        Number = {17},
        Pages = {1285-1288},
        Publisher = {AMERICAN PHYSICAL SOC},
        Timescited = {1164},
        Title = {SEMIEMPIRICAL, QUANTUM-MECHANICAL CALCULATION OF HYDROGEN EMBRITTLEMENT IN METALS},
        Volume = {50},
        Year = {1983},
        Bdsk-Url-1 = {http://gateway.isiknowledge.com/gateway/Gateway.cgi?GWVersion=2&SrcAuth=Alerting&SrcApp=Alerting&DestApp=WOS&DestLinkType=FullRecord;KeyUT=A1983QL86700017}}

@article{Daw84,
        Author = {M.~S. Daw and M.~I. Baskes},
        Date-Added = {2009-01-08 16:50:56 -0500},
        Date-Modified = {2009-01-25 20:46:33 -0500},
        Journal = {Phys. Rev. B},
        Number = 12,
        Pages = {6443-6453},
        Title = {Embedded-atom method: Derivation and application to                   impurities, surfaces, and other defects in metals},
        Volume = 29,
        Year = 1984}

@article{Daw89,
        Author = {Murray~S. Daw},
        Date-Added = {2009-01-08 16:50:56 -0500},
        Date-Modified = {2009-01-08 16:50:56 -0500},
        Journal = prb,
        Pages = {7441-7452},
        Title = {Model of metallic cohesion: The embedded-atom method},
        Volume = 39,
        Year = 1989}

@article{FBD86,
        Author = {S.~M. Foiles and M.~I. Baskes and M.~S. Daw},
        Date-Added = {2009-01-08 16:50:56 -0500},
        Date-Modified = {2009-01-08 16:50:56 -0500},
        Journal = prb,
        Number = 12,
        Pages = 7983,
        Title = {Embedded-atom-method functions for the fcc metals $\mbox{Cu, Ag, Au, Ni, Pd, Pt}$, and their alloys},
        Volume = 33,
        Year = 1986}

@article{DAW:1993p1640,
        Abstract = {The embedded-atom method (EAM) is a semi-empirical, many-atom potential for computing the total energy of a metallic system. It is especially useful for systems with large unit cells, and is appropriate for metals with empty or filled d bands. With the EAM, the materials community has investigated many problems of interest: point defects, melting, alloying, grain boundary structure and energy, dislocations, segregation, fracture, surface structure, and epitaxial growth. In general, most of the EAM calculations have been carried out in close connection with experimental work. We review here the history, development, and application of the EAM.},
        Affiliation = {SANDIA NATL LABS,MAT {\&} PROC RES DEPT,LIVERMORE,CA 94551},
        Author = {MS Daw and SM Foiles and MI Baskes},
        Date-Added = {2009-01-08 15:43:13 -0500},
        Date-Modified = {2009-01-25 20:42:39 -0500},
        Journal = {Mater. Sci. Rep.},
        Keywords = {Order-Disorder Transitions, Monte-Carlo Simulations, He-Surface Scattering, Corrected Effective-Medium, Energy-Ion-Scattering, Rayleigh Phonon-Dispersion, 001 Twist Boundaries, Fcc 110 Surfaces, Missing-Row Model, X-Ray-Diffraction},
        Language = {English},
        Month = {Jan},
        Number = {7-8},
        Pages = {251--310},
        Pmid = {A1993LB24800001},
        Rating = {0},
        Title = {THE EMBEDDED-ATOM METHOD - A REVIEW OF THEORY AND APPLICATIONS},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1640},
        Volume = {9},
        Year = {1993}}

@book{Nieminen:1990hw,
        Address = {Berlin},
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245 00 $aMany-atom interactions in solids :$bproceedings of the international workshop, Pajulahti, Finland, June 5-9, 1989 /$ceditors, R.M. Nieminen, M.J. Puska, and M.J. Manninen.
260    $aBerlin ;$aNew York :$bSpringer-Verlag,$cc1990.
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700 1  $aPuska, M. J.$q(Martti J.),$d1955-
700 1  $aManninen, M. J.$q(Matti J.),$d1950-
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        Author = {Heine, V. and Hafnner, J.},
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        Date-Modified = {2009-01-08 15:40:52 -0500},
        Dewey-Call-Number = {530.4/1},
        Editor = {Nieminen, R. M and Puska, M. J and Manninen, M. J},
        Genre = {Solid state physics},
        Isbn = {3540526579 (alk. paper)},
        Library-Id = {90039677},
        Publisher = {Springer-Verlag},
        Series = {Springer proceedings in physics},
        Title = {Many-atom interactions in solids: proceedings of the international workshop, Pajulahti, Finland, June 5-9, 1989},
        Volume = {48},
        Year = {1990}}

@book{Egelstaff:1992yb,
        Address = {Oxford},
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100 1  $aEgelstaff, P. A.$q(Peter A.)
245 13 $aAn introduction to the liquid state /$cP.A. Egelstaff.
250    $a2nd ed.
260    $aOxford :$bClarendon Press ;$aNew York :$bOxford University Press,$c1992.
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        Author = {Egelstaff, P. A},
        Call-Number = {QD541},
        Date-Added = {2009-01-07 15:11:47 -0500},
        Date-Modified = {2009-01-07 15:11:47 -0500},
        Dewey-Call-Number = {530.4/2},
        Edition = {2nd ed},
        Genre = {Liquids},
        Isbn = {0198510128},
        Library-Id = {91046333},
        Publisher = {Clarendon Press},
        Title = {An introduction to the liquid state},
        Url = {http://www.loc.gov/catdir/enhancements/fy0635/91046333-d.html},
        Volume = {7},
        Year = {1992},
        Bdsk-Url-1 = {http://www.loc.gov/catdir/enhancements/fy0635/91046333-d.html}}

@article{Medasani:2007uq,
        Abstract = {We employ first-principles and empirical computational methods to study the surface energy and surface stress of silver nanoparticles. The structures, cohesive energies, and lattice contractions of spherical Ag nanoclusters in the size range 0.5-5.5 nm are analyzed using two different theoretical approaches: an ab initio density functional pseudopotential technique combined with the generalized gradient approximation and the embedded atom method. The surface energies and stresses obtained via the embedded atom method are found to be in good agreement with those predicted by the gradient-corrected ab initio density functional formalism. We estimate the surface energy of Ag nanoclusters to be in the range of 1.0-2.2 J/m(2). Our values are close to the bulk surface energy of silver, but are significantly lower than the recently reported value of 7.2 J/m(2) for free Ag nanoparticles derived from the Kelvin equation.},
        Author = {Medasani, Bharat and Park, Young Ho and Vasiliev, Igor},
        Date-Added = {2008-12-30 15:37:51 -0500},
        Date-Modified = {2008-12-30 15:37:51 -0500},
        Doi = {ARTN 235436},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/PhysRevB_75_235436.pdf},
        Title = {Theoretical study of the surface energy, stress, and lattice contraction of silver nanoparticles},
        Volume = {75},
        Year = {2007},
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        Bdsk-Url-1 = {http://dx.doi.org/235436}}

@article{Wang:2005qy,
        Abstract = {The surface structures of cubo-octahedral Pt-Mo nanoparticles have been investigated using the Monte Carlo method and modified embedded atom method potentials that we developed for Pt-Mo alloys. The cubo-octahedral Pt-Mo nanoparticles are constructed with disordered fcc configurations, with sizes from 2.5 to 5.0 nm, and with Pt concentrations from 60 to 90 atom \%. The equilibrium Pt-Mo nanoparticle configurations were generated through Monte Carlo simulations allowing both atomic displacements and element exchanges at 600 K. We predict that the Pt atoms weakly segregate to the surfaces of such nanoparticles. The Pt concentrations in the surface are calculated to be 5-14 atom \% higher than the Pt concentrations of the nanoparticles. Moreover, the Pt atoms preferentially segregate to the facet sites of the surface, while the Pt and Mo atoms tend to alternate along the edges and vertexes of these nanoparticles. We found that decreasing the size or increasing the Pt concentration leads to higher Pt concentrations but fewer Pt-Mo pairs in the Pt-Mo nanoparticle surfaces.},
        Author = {Wang, GF and Van Hove, MA and Ross, PN and Baskes, MI},
        Date-Added = {2008-12-30 15:37:40 -0500},
        Date-Modified = {2008-12-30 15:37:40 -0500},
        Doi = {DOI 10.1021/jp050116n},
        Journal = {J. Phys. Chem. B},
        Pages = {11683-11692},
        Title = {Surface structures of cubo-octahedral Pt-Mo catalyst nanoparticles from Monte Carlo simulations},
        Volume = {109},
        Year = {2005},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/jp050116n}}

@article{Chui:2003fk,
        Abstract = {Molecular dynamics simulations of a platinum nanocluster consisting 250 atoms were performed at different temperatures between 70 K and 298 K. The semi-empirical, many-body Sutton-Chen (SC) potential was used to model the interatomic interaction in the metallic system. Regions of core or bulk-like atoms and surface atoms can be defined from analyses of structures, atomic coordination, and the local density function of atoms as defined in the SC potential. The core atoms in the nanoparticle behave as bulk-like metal atoms with a predominant face centered cubic (fcc) packing. The interface between surface atoms and core atoms is marked by a peak in the local density function and corresponds to near surface atoms. The near surface atoms and surface atoms prefer a hexagonal closed packing (hcp). The temperature and size effects on structures of the nanoparticle and the dynamics of the surface region and the core region are discussed.},
        Author = {Chui, YH and Chan, KY},
        Date-Added = {2008-12-30 15:37:25 -0500},
        Date-Modified = {2008-12-30 15:37:25 -0500},
        Doi = {DOI 10.1039/b302122j},
        Journal = {Phys. Chem. Chem. Phys.},
        Pages = {2869-2874},
        Title = {Analyses of surface and core atoms in a platinum nanoparticle},
        Volume = {5},
        Year = {2003},
        Bdsk-Url-1 = {http://dx.doi.org/10.1039/b302122j}}

@article{Sankaranarayanan:2005lr,
        Abstract = {Bimetallic nanoclusters are of interest because of their utility in catalysis and sensors, The thermal characteristics of bimetallic Pt-Pd nanoclusters of different sizes and compositions were investigated through molecular dynamics simulations using quantum Sutton-Chen (QSC) many-body potentials, Monte Carlo simulations employing the bond order simulation model were used to generate minimum energy configurations, which were utilized as the starting point for molecular dynamics simulations. The calculated initial configurations of the Pt-Pd system consisted of surface segregated Pd atoms and a Pt-rich core, Melting characteristics were studied by following the changes in potential energy and heat capacity as functions of temperature, Structural changes accompanying the thermal evolution were studied by the bond order parameter method. The Pt-Pd clusters exhibited a two-stage melting: surface melting of the external Pd atoms followed by homogeneous melting of the Pt core. These transitions were found to depend on the composition and size of the nanocluster. Melting temperatures of the nanoclusters were found to be much lower than those of bulk Pt and Pd. Bulk melting temperatures of Pd and Pt simulated using periodic boundary conditions compare well with experimental values, thus providing justification for the use of QSC potentials in these simulations. Deformation parameters were calculated to characterize the structural evolution resulting from diffusion of Pd and Pt atoms, The results indicate that in Pd-Pt clusters, Pd atoms prefer to remain at the surface even after melting. In addition, Pt also tends to diffuse to the surface after melting due to reduction of its surface energy with temperature. This mixing pattern is different from those reported in some of the earlier Studies on melting of bimetallics.},
        Author = {Sankaranarayanan, SKRS and Bhethanabotla, VR and Joseph, B},
        Date-Added = {2008-12-30 15:37:06 -0500},
        Date-Modified = {2008-12-30 15:37:06 -0500},
        Doi = {ARTN 195415},
        Journal = {Phys. Rev. B},
        Title = {Molecular dynamics simulation study of the melting of Pd-Pt nanoclusters},
        Volume = {71},
        Year = {2005},
        Bdsk-Url-1 = {http://dx.doi.org/195415}}

@article{Alcoutlabi:2005kx,
        Abstract = {In this article, the effects of size and confinement at the nanometre size scale on both the melting temperature, T-m, and the glass transition temperature, T-g, are reviewed. Although there is an accepted thermodynamic model (the Gibbs-Thomson equation) for explaining the shift in the first-order transition, T-m, for confined materials, the depression of the melting point is still not fully understood and clearly requires further investigation. However, the main thrust of the work is a review of the field of confinement and size effects on the glass transition temperature. We present in detail the dynamic, thermodynamic and pseudo-thermodynamic measurements reported for the glass transition in confined geometries for both small molecules confined in nanopores and for ultrathin polymer films. We survey the observations that show that the glass transition temperature decreases, increases, remains the same or even disappears depending upon details of the experimental (or molecular simulation) conditions. Indeed, different behaviours have been observed for the same material depending on the experimental methods used. It seems that the existing theories of T-g are unable to explain the range of behaviours seen at the nanometre size scale, in part because the glass transition phenomenon itself is not fully understood. Importantly, here we conclude that the vast majority of the experiments have been carried out carefully and the results are reproducible. What is currently lacking appears to be an overall view, which accounts for the range of observations. The field seems to be experimentally and empirically driven rather than responding to major theoretical developments.},
        Author = {Alcoutlabi, M and McKenna, GB},
        Date-Added = {2008-12-30 15:36:43 -0500},
        Date-Modified = {2008-12-30 15:36:43 -0500},
        Journal = {J. Phys.: Condens. Matter},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/cm5_15_R01.pdf},
        Pages = {R461-R524},
        Title = {Effects of confinement on material behaviour at the nanometre size scale},
        Volume = {17},
        Year = {2005},
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@article{Wang:2003fk,
        Abstract = {The Debye temperature and glass transition temperature of a variety of bulk metallic glasses (BMGs) were determined by acoustic measurement and differential scanning calorimetry, respectively. The relationship between the Debye temperature and glass transition temperature of these BMGs was analyzed, and their observed correlation was interpreted in terms of the characteristics of the glass transition in BMGs.},
        Author = {Wang, WH and Wen, P and Zhao, DQ and Pan, MX and Wang, RJ},
        Date-Added = {2008-12-30 15:36:27 -0500},
        Date-Modified = {2008-12-30 15:36:27 -0500},
        Journal = {J. Mater. Res. },
        Local-Url = {file://localhost/Users/charles/Documents/Papers/494770.pdf},
        Pages = {2747-2751},
        Title = {Relationship between glass transition temperature and Debye temperature in bulk metallic glasses},
        Volume = {18},
        Year = {2003},
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@book{Massalski:1986rt,
        Address = {Metals Park, Ohio},
        Annote = {LDR    01406cam  2200349 a 4500
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050 00 $aTN690$b.B528 1986
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245 00 $aBinary alloy phase diagrams /$ceditor-in-chief, Thaddeus B. Massalski ; editors, Joanne L. Murray, Lawrence H. Bennett, Hugh Baker.
260    $aMetals Park, Ohio :$bAmerican Society for Metals,$cc1986.
300    $a2 v. (xiii, 2224 p.) :$bill. ;$c29 cm.
500    $a"Alloy phase diagram master grid" in pocket.
504    $aBibliography: v. 1, p. xiii.
500    $aIncludes indexes.
650  0 $aAlloys.
650  0 $aPhase diagrams.
650  0 $aBinary systems (Metallurgy)
700 1  $aMassalski, T. B.
700 1  $aMurray, Joanne L.
700 1  $aBennett, L. H.$q(Lawrence Herman),$d1930-
700 1  $aBaker, Hugh.
952    $aLC's copy ("First printing, October 1986") has "American Society for Metals" on t.p., t.p. verso, and throughout text; "Metals Park, Ohio 44073" appears on t.p. ta01 12-16-2004
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},
        Author = {Massalski, T. B and Murray, Joanne L and Bennett, L. H and Baker, Hugh},
        Call-Number = {TN690},
        Date-Added = {2008-12-30 15:36:16 -0500},
        Date-Modified = {2008-12-30 15:36:16 -0500},
        Dewey-Call-Number = {669/.94},
        Genre = {Alloys},
        Isbn = {0871702614 (set)},
        Library-Id = {86017350},
        Publisher = {American Society for Metals},
        Title = {Binary alloy phase diagrams},
        Year = {1986}}

@article{Greer:1995qy,
        Abstract = {Amorphous metallic alloys, relative newcomers to the world of glasses, have properties that are unusual for solid metals. The metallic glasses, which exist in a very wide variety of compositions, combine fundamental interest with practical applications. They also serve as precursors for exciting new nanocrystalline materials. Their magnetic (soft and hard) and mechanical properties are of particular interest.},
        Author = {Greer, A. Lindsay},
        Copyright = {Copyright 1995 American Association for the Advancement of Science},
        Date-Added = {2008-12-30 15:36:03 -0500},
        Date-Modified = {2009-01-25 20:39:25 -0500},
        Group = {Frontiers in Materials Science},
        Issn = {0036-8075},
        Journal = {Science},
        Jstor_Articletype = {Full Length Article},
        Jstor_Date = {19950331},
        Jstor_Formatteddate = {Mar. 31, 1995},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/greer_science_met_glass.pdf},
        Month = {Mar},
        Number = {5206},
        Pages = {1947-1953},
        Publisher = {American Association for the Advancement of Science},
        Series = {3},
        Title = {Metallic Glasses},
        Url = {http://links.jstor.org/sici?sici=0036-8075%2819950331%293%3A267%3A5206%3C1947%3AMG%3E2.0.CO%3B2-T},
        Volume = {267},
        Year = {1995},
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        Bdsk-Url-1 = {http://links.jstor.org/sici?sici=0036-8075(19950331)3:267:5206%3C1947:MG%3E2.0.CO;2-T}}

@article{Wilson:2002uq,
        Abstract = {We investigate suspensions of 3-10 nm diameter Au, Pt, and AuPd nanoparticles as probes of thermal transport in fluids and determine approximate values for the thermal conductance G of the particle/fluid interfaces. Subpicosecond lambda=770 nm optical pulses from a Ti:sapphire mode-locked laser are used to heat the particles and interrogate the decay of their temperature through time-resolved changes in optical absorption. The thermal decay of alkanethiol-terminated Au nanoparticles in toluene is partially obscured by other effects; we set a lower limit G>20 MW m(-2)K(-1). The thermal decay of citrate-stabilized Pt nanoparticles in water gives Gapproximate to130 MW m(-2) K-1. AuPd alloy nanoparticles in toluene and stabilized by alkanethiol termination give Gapproximate to5 MW m(-2) K-1. The measured G are within a factor of 2 of theoretical estimates based on the diffuse-mismatch model.},
        Author = {Wilson, OM and Hu, XY and Cahill, DG and Braun, PV},
        Date-Added = {2008-12-30 15:35:56 -0500},
        Date-Modified = {2008-12-30 15:35:56 -0500},
        Doi = {ARTN 224301},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/e2243010.pdf},
        Title = {Colloidal metal particles as probes of nanoscale thermal transport in fluids},
        Volume = {66},
        Year = {2002},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/224301}}

@article{Hu:2004lr,
        Author = {Hu, M. and Petrova, H. and Hartland, G. V.},
        Date = {JUN 21},
        Date-Added = {2008-12-30 15:35:41 -0500},
        Date-Modified = {2008-12-30 15:35:41 -0500},
        Isi = {ISI:000222228000005},
        Issn = {0009-2614},
        Journal = {Chem. Phys. Let.},
        Month = {Jun},
        Number = {4-6},
        Pages = {220--225},
        Publication-Type = {J},
        Title = {Investigation of the properties of gold nanoparticles in aqueous solution at extremely high lattice temperatures},
        Volume = {391},
        Year = {2004}}

@article{Plech:2003yq,
        Abstract = {The lattice expansion and relaxation of noble-metal nanoparticles heated by intense femtosecond laser pulses are measured by pump-probe time-resolved X-ray scattering. Following the laser pulse, shape and angular shift of the (111) Bragg reflection from crystalline silver and gold particles with diameters from 20 to 100 nm are resolved stroboscopically using 100 ps X-ray pulses from a synchrotron. We observe a transient lattice expansion that corresponds to a laser-induced temperature rise of up to 200 K, and a subsequent lattice relaxation. The relaxation occurs within several hundred picoseconds for embedded silver particles, and several nanoseconds for supported free gold particles. The relaxation time shows a strong dependence on particle size. The relaxation rate appears to be limited by the thermal coupling of the particles to the matrix and substrate, respectively, rather than by bulk thermal diffusion. Furthermore, X-ray diffraction can resolve the internal strain state of the nanoparticles to separate non-thermal from thermal motion of the lattice.},
        Author = {Plech, A and Kurbitz, S and Berg, KJ and Graener, H and Berg, G and Gresillon, S and Kaempfe, M and Feldmann, J and Wulff, M and von Plessen, G},
        Date-Added = {2008-12-30 15:34:48 -0500},
        Date-Modified = {2008-12-30 15:34:48 -0500},
        Journal = {Europhys. Lett.},
        Pages = {762-768},
        Title = {Time-resolved X-ray diffraction on laser-excited metal nanoparticles},
        Volume = {61},
        Year = {2003}}

@article{Plech:2007rt,
        Abstract = {A thermal phase transition has been resolved in gold nanoparticles supported on a surface. By use of asynchronous optical sampling with coupled femtosecond oscillators, the Lamb vibrational modes could be resolved as a function of annealing temperature. At a temperature of 104 degrees C the damping rate and phase changes abruptly, indicating a structural transition in the particle, which is explained as the onset of surface melting.},
        Author = {Plech, Anton and Cerna, Roland and Kotaidis, Vassilios and Hudert, Florian and Bartels, Albrecht and Dekorsy, Thomas},
        Date-Added = {2008-12-30 15:34:48 -0500},
        Date-Modified = {2008-12-30 15:34:48 -0500},
        Doi = {DOI 10.1021/nl070187t},
        Journal = {Nano Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/nl070187t.pdf},
        Pages = {1026-1031},
        Title = {A surface phase transition of supported gold nanoparticles},
        Volume = {7},
        Year = {2007},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/nl070187t}}

@article{Mafune01,
        Author = {Mafune, F. and Kohno, J. and Takeda, Y. and Kondow, T.},
        Date = {SEP 27},
        Date-Added = {2008-12-30 15:34:32 -0500},
        Date-Modified = {2008-12-30 15:34:32 -0500},
        Isi = {ISI:000171214200005},
        Issn = {1089-5647},
        Journal = {J. Phys. Chem. B},
        Month = {Sep},
        Number = {38},
        Pages = {9050--9056},
        Publication-Type = {J},
        Title = {Dissociation and aggregation of gold nanoparticles under laser irradiation},
        Volume = {105},
        Year = {2001}}

@article{Dick:2002qy,
        Abstract = {We report on the size dependence of the melting temperature of silica-encapsulated gold nanoparticles. The melting point was determined using differential thermal analysis (DTA) coupled to thermal gravimetric analysis (TGA) techniques. The small gold particles, with sizes ranging from 1.5 to 20 nm, were synthesized using radiolytic and chemical reduction procedures and then coated with porous silica shells to isolate the particles from one another. The resulting silica-encapsulated gold particles show clear melting endotherms in the DTA scan with no accompanying weight loss of the material in the TGA examination. The silica shell acts as a nanocrucible for the melting gold with little effect on the melting temperature itself, even though the analytical procedure destroys the particles once they melt. Phenomenological thermodynamic predictions of the size dependence of the melting point of gold agree with the experimental observation. Implications of these observations to the self-diffusion coefficient of gold in the nanoparticles are discussed, especially as they relate to the spontaneous alloying of core-shell bimetallic particles.},
        Author = {Dick, K and Dhanasekaran, T and Zhang, ZY and Meisel, D},
        Date-Added = {2008-12-30 15:34:20 -0500},
        Date-Modified = {2008-12-30 15:34:20 -0500},
        Doi = {DOI 10.1021/ja017281a},
        Journal = {J. Amer. Chem. Soc.},
        Pages = {2312-2317},
        Title = {Size-dependent melting of silica-encapsulated gold nanoparticles},
        Volume = {124},
        Year = {2002},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/ja017281a}}

@misc{Hu:2006lr,
        Abstract = {The surface plasmon resonance peaks of gold nanostructures can be tuned from the visible to the near infrared region by controlling the shape and structure ( solid vs. hollow). In this tutorial review we highlight this concept by comparing four typical examples: nanospheres, nanorods, nanoshells, and nanocages. A combination of this optical tunability with the inertness of gold makes gold nanostructures well suited for various biomedical applications.},
        Author = {Hu, Min and Chen, Jingyi and Li, Zhi-Yuan and Au, Leslie and Hartland, Gregory V. and Li, Xingde and Marquez, Manuel and Xia, Younan},
        Date-Added = {2008-12-30 15:34:06 -0500},
        Date-Modified = {2008-12-30 15:34:06 -0500},
        Doi = {DOI 10.1039/b517615h},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/b517615h.pdf},
        Note = {Chem. Soc. Rev.},
        Pages = {1084-1094},
        Title = {Gold nanostructures: engineering their plasmonic properties for biomedical applications},
        Volume = {35},
        Year = {2006},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1039/b517615h}}

@misc{West:2003fk,
        Abstract = {Advances in chemistry and physics are providing an expanding array of nanostructured materials with unique and powerful optical properties. These nanomaterials provide a new set of tools that are available to biomedical engineers, biologists, and medical scientists who seek new tools as biosensors and probes of biological fluids, cells, and tissue chemistry and function. Nanomaterials are also being used to develop optically controlled devices for applications such as modulated drug delivery as well as optical therapeutics. This review discusses applications that have been successfully demonstrated using nanomaterials including semiconductor nanocrystals, gold nanoparticles, gold nanoshells, and silver plasmon resonant particles.},
        Author = {West, JL and Halas, NJ},
        Date-Added = {2008-12-30 15:33:50 -0500},
        Date-Modified = {2008-12-30 15:33:50 -0500},
        Doi = {DOI 10.1146/annurev.bioeng.5.011303.120723},
        Keywords = {nanotechnology; nanoparticle; optics; biosensor; quantum dot; gold colloid; plasmon resonant particle; nanoshell},
        Note = {Annu. Rev. Biomed. Eng.},
        Pages = {285-292},
        Title = {Engineered nanomaterials for biophotonics applications: Improving sensing, imaging, and therapeutics},
        Volume = {5},
        Year = {2003},
        Bdsk-Url-1 = {http://dx.doi.org/10.1146/annurev.bioeng.5.011303.120723}}

@article{Finnis84,
        Author = {M.~W Finnis and J.~E. Sinclair },
        Date-Added = {2008-12-30 15:27:22 -0500},
        Date-Modified = {2008-12-30 15:27:22 -0500},
        Journal = {Phil. Mag. A},
        Pages = {45-55},
        Title = {A Simple Empirical N-Body Potential for Transition-Metals},
        Volume = 50,
        Year = 1984}

@article{Voter:87,
        Author = {A.F. Voter and S.P. Chen},
        Date-Added = {2008-12-30 15:27:02 -0500},
        Date-Modified = {2008-12-30 15:27:02 -0500},
        Journal = {Mat. Res. Soc. Symp. Proc.},
        Pages = {175},
        Title = {Accurate Interatomic Potentials for Ni, Al, and Ni3Al},
        Volume = {82},
        Year = {1987}}

@book{Iida1988,
        Address = {Oxford},
        Author = {T. Iida and R.~I.~L. Guthrie},
        Date-Added = {2008-12-30 15:14:48 -0500},
        Date-Modified = {2008-12-30 15:14:48 -0500},
        Publisher = {Clarendon Press},
        Title = {The Physical Properties of Liquid Metals},
        Year = 1988}

@article{Cerullo1999,
        Author = {G. Cerullo and S. De~Silvestri and U. Banin},
        Date-Added = {2008-12-30 15:14:05 -0500},
        Date-Modified = {2009-01-25 21:38:30 -0500},
        Journal = {Phys. Rev. B},
        Pages = {1928-1932},
        Title = {Size-dependent dynamics of coherent acoustic phonons in nanocrystal quantum dots},
        Volume = 60,
        Year = 1999}

@article{Lamb1882,
        Author = {H. Lamb},
        Date-Added = {2008-12-30 15:13:30 -0500},
        Date-Modified = {2008-12-30 15:13:30 -0500},
        Journal = {Proc. London Math. Soc.},
        Pages = {189-212},
        Title = {On the Vibrations of an Elastic Sphere},
        Volume = 13,
        Year = 1882}

@article{melchionna93,
        Author = {S. Melchionna and G. Ciccotti and B.~L. Holian},
        Date-Added = {2008-12-30 15:12:20 -0500},
        Date-Modified = {2008-12-30 15:12:20 -0500},
        Journal = {Mol. Phys.},
        Pages = {533-544},
        Title = {Hoover {\sc npt} dynamics for systems varying in shape and size},
        Volume = 78,
        Year = 1993}

@book{BernePecora,
        Address = {Mineola, New York},
        Author = {B.~J. Berne and R. Pecora},
        Chapter = 10,
        Date-Added = {2008-12-30 15:11:50 -0500},
        Date-Modified = {2008-12-30 15:11:50 -0500},
        Pages = 269,
        Publisher = {Dover Publications, Inc.},
        Title = {Dynamic Light Scattering},
        Year = 2000}

@misc{qhull,
        Date-Added = {2008-12-30 15:11:00 -0500},
        Date-Modified = {2008-12-30 15:11:00 -0500},
        Note = {software library is available from the National Science and Technology Research Center for Computation and Visualization of Geometric Structures (The Geometry Center), University of Minnesota. {\tt http://www.geom.umn.edu/software/qhull/}},
        Title = {Qhull},
        Year = 1993}

@article{hoover85,
        Author = {W.~G. Hoover},
        Date-Added = {2008-12-30 15:10:00 -0500},
        Date-Modified = {2009-01-25 21:38:03 -0500},
        Journal = {Phys. Rev. A},
        Pages = 1695,
        Title = {Canonical dynamics: Equilibrium phase-space distributions},
        Volume = 31,
        Year = 1985}

@article{plimpton95,
        Author = {S. Plimpton},
        Date-Added = {2008-12-30 15:09:36 -0500},
        Date-Modified = {2008-12-30 15:09:36 -0500},
        Journal = jcompp,
        Pages = {1-19},
        Title = {Fast Parallel Algorithms for Short-Range Molecular Dymanics},
        Volume = 117,
        Year = 1995}

@article{plimpton93,
        Author = {S.~J. Plimpton and B.~A. Hendrickson},
        Date-Added = {2008-12-30 15:09:36 -0500},
        Date-Modified = {2008-12-30 15:09:36 -0500},
        Journal = {MRS Proceedings},
        Pages = 37,
        Title = {Parallel Molecular Dynamics with the Embedded Atom Method},
        Volume = 291,
        Year = 1993}

@article{Simon2001,
        Author = {D.~T. Simon and M.~R. Geller},
        Date-Added = {2008-12-30 15:03:24 -0500},
        Date-Modified = {2009-01-25 21:36:23 -0500},
        Journal = {Phys. Rev. B},
        Pages = 115412,
        Title = {Electron-phonon dynamics in an ensemble of nearly isolated nanoparticles},
        Volume = 64,
        Year = 2001}

@article{Hartland00,
        Author = {J. ~H. Hodak and A. Henglein and G. ~V. Hartland},
        Date-Added = {2008-12-30 15:03:13 -0500},
        Date-Modified = {2009-01-25 21:37:09 -0500},
        Journal = {J. Chem. Phys},
        Pages = {5053-5055},
        Title = {Coherent Excitation of Acoustic Breathing Modes in Bimetallic                    Core-Shell Nanoparticles},
        Volume = 104,
        Year = 2000}

@article{hartland02d,
        Author = {M. Hu and G.~V. Hartland},
        Date-Added = {2008-12-30 15:02:00 -0500},
        Date-Modified = {2008-12-30 15:02:00 -0500},
        Journal = {Proceeding of SPIE},
        Month = {July},
        Title = {Photophysics of Metal Nanoparticles: Heat Dissipation                   and Coherent Excitation of Phonon Modes},
        Volume = 4803,
        Year = 2002}

@article{hartland02a,
        Author = {G.~V. Hartland},
        Date-Added = {2008-12-30 15:00:39 -0500},
        Date-Modified = {2009-01-25 21:34:57 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {8048-8055},
        Title = {Coherent vibrational motion in metal particles:                   Determination of the vibrational amplitude and                   excitation mechanism},
        Volume = 116,
        Year = 2002}

@article{hartland02c,
        Author = {J.~E. Sader and G.~V. Hartland and P. Mulvaney},
        Date-Added = {2008-12-30 15:00:39 -0500},
        Date-Modified = {2009-01-25 21:29:42 -0500},
        Journal = {J. Phys. Chem. B},
        Pages = {1399-1402},
        Title = {Theory of Acoustic Breathing Modes of Core-Shell                   Nanoparticles},
        Volume = 106,
        Year = 2002}

@article{henglein99,
        Author = {J.~H. Hodak and A Henglein and G.~V. Hartland},
        Date-Added = {2008-12-30 14:59:42 -0500},
        Date-Modified = {2009-01-25 21:34:13 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {8613-8621},
        Title = {Size Dependent properties of Au Particles: Coherent                    Excitation and Dephasing of Acoustic Vibrational Modes},
        Volume = 111,
        Year = 1999}

@article{delfatti99,
        Author = {N. {Del Fatti} and C. Voisin and F. Chevy and F. Vallee and                    C. Flytzanis},
        Date-Added = {2008-12-30 14:59:01 -0500},
        Date-Modified = {2009-01-25 21:33:18 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {11484-11487},
        Title = {Coherent Acoustic Mode Oscillation and Damping in Silver                   Nanoparticles},
        Volume = 110,
        Year = 1999}

@article{el-sayed00,
        Author = {S. Link and Z.~L. Wang and M.~A. El-Sayed},
        Date-Added = {2008-12-30 14:57:35 -0500},
        Date-Modified = {2009-01-25 21:30:26 -0500},
        Journal = {J. Phys. Chem. B},
        Pages = {7867-7870},
        Title = {How Does a Gold Nanorod Melt?},
        Volume = 104,
        Year = 2000}

@article{el-sayed01,
        Author = {S. Link and M.~A. El-Sayed},
        Date-Added = {2008-12-30 14:57:35 -0500},
        Date-Modified = {2009-01-25 21:30:41 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {2362-2368},
        Title = {Spectroscopic Determination of the Melting Energy of a                   Gold Nanorod},
        Volume = 114,
        Year = 2001}

@book{Stone02,
        Author = {A.~J. Stone},
        Date-Added = {2008-12-29 15:44:15 -0500},
        Date-Modified = {2008-12-29 15:44:15 -0500},
        Editor = {J.~S. Rowlinson},
        Publisher = {Oxford University Press, Inc.},
        Title = {The Theory of Intermolecular Forces},
        Year = {2002}}

@book{Allen87,
        Address = {New York},
        Author = {M.~P. Allen and D.~J. Tildesley},
        Date-Added = {2008-12-29 11:38:12 -0500},
        Date-Modified = {2008-12-29 11:38:12 -0500},
        Publisher = {Oxford University Press},
        Title = {Computer Simulations of Liquids},
        Year = 1987}

@book{Leach01,
        Address = {Harlow, England},
        Author = {A.~R. Leach},
        Date-Added = {2008-12-29 11:37:59 -0500},
        Date-Modified = {2008-12-29 11:37:59 -0500},
        Edition = {2nd},
        Publisher = {Pearson Educated Limited},
        Title = {Molecular Modeling: Principles and Applications},
        Year = 2001}

@book{Frenkel02,
        Address = {New York},
        Author = {D. Frenkel and B. Smit},
        Date-Added = {2008-12-29 11:37:16 -0500},
        Date-Modified = {2008-12-29 11:37:16 -0500},
        Edition = {2nd},
        Publisher = {Academic Press},
        Title = {Understanding Molecular Simulation: \uppercase{F}rom Algorithms to Applications},
        Year = 2002}

@book{Egelstaff:1967ft,
        Author = {P.~A. Egelstaff},
        Date-Added = {2008-12-27 16:18:22 -0500},
        Date-Modified = {2008-12-27 16:26:32 -0500},
        Edition = {1st},
        Publisher = {Academic Press},
        Title = {An introduction to the liquid state},
        Year = {1967}}

@book{Ashcroft:1976zt,
        Address = {New York},
        Annote = {LDR    00785cam  2200241   4500
001    4569013
005    19900306143213.2
008    740517s1976    nyua     b    001 0 eng  
035    $9(DLC)   74009772
906    $a7$bcbc$corignew$d1$eocip$f19$gy-gencatlg
010    $a   74009772 
020    $a0030839939
040    $aDLC$cDLC$dDLC
050 00 $aQC176$b.A83
082 00 $a530.4/1
100 1  $aAshcroft, Neil W.
245 10 $aSolid state physics$c[by] Neil W. Ashcroft [and] N. David Mermin.
260    $aNew York,$bHolt, Rinehart and Winston$c[c1976]
300    $axxi, 826 p.$billus.$c25 cm.
504    $aIncludes bibliographical references.
650  0 $aSolid state physics.
700 1  $aMermin, N. David,$ejoint author.
991    $bc-GenColl$hQC176$i.A83$p00015119688$tCopy 1$wBOOKS
},
        Author = {Ashcroft, Neil W and Mermin, N. David},
        Call-Number = {QC176},
        Date-Added = {2008-12-25 15:57:05 -0500},
        Date-Modified = {2008-12-25 15:57:05 -0500},
        Dewey-Call-Number = {530.4/1},
        Genre = {Solid state physics},
        Isbn = {0030839939},
        Library-Id = {74009772},
        Publisher = {Holt, Rinehart and Winston},
        Title = {Solid state physics},
        Year = {1976}}

@article{Drude:1900p1481,
        Author = {P Drude},
        Date-Added = {2008-12-22 16:17:32 -0500},
        Date-Modified = {2008-12-22 16:17:32 -0500},
        Journal = {Ann Phys-Berlin},
        Language = {German},
        Month = {Jan},
        Number = {3},
        Pages = {566--613},
        Pmid = {000201988200011},
        Rating = {0},
        Title = {On the electron theory of metals},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1481},
        Volume = {1},
        Year = {1900}}

@article{Drude:1900p1479,
        Author = {P Drude},
        Date-Added = {2008-12-22 16:17:32 -0500},
        Date-Modified = {2008-12-22 16:17:32 -0500},
        Journal = {Phys Z},
        Language = {German},
        Month = {Jan},
        Pages = {161--165},
        Pmid = {000201033300057},
        Rating = {0},
        Title = {On the ionic theory of metals},
        Uri = {papers://81DEADED-995F-4F38-B0F9-1857A68D387E/Paper/p1479},
        Volume = {1},
        Year = {1900}}

@book{Ashcroft:1976ztch3,
        Address = {New York},
        Annote = {LDR    00785cam  2200241   4500
001    4569013
005    19900306143213.2
008    740517s1976    nyua     b    001 0 eng  
035    $9(DLC)   74009772
906    $a7$bcbc$corignew$d1$eocip$f19$gy-gencatlg
010    $a   74009772 
020    $a0030839939
040    $aDLC$cDLC$dDLC
050 00 $aQC176$b.A83
082 00 $a530.4/1
100 1  $aAshcroft, Neil W.
245 10 $aSolid state physics$c[by] Neil W. Ashcroft [and] N. David Mermin.
260    $aNew York,$bHolt, Rinehart and Winston$c[c1976]
300    $axxi, 826 p.$billus.$c25 cm.
504    $aIncludes bibliographical references.
650  0 $aSolid state physics.
700 1  $aMermin, N. David,$ejoint author.
991    $bc-GenColl$hQC176$i.A83$p00015119688$tCopy 1$wBOOKS
},
        Author = {Ashcroft, Neil W and Mermin, N. David},
        Call-Number = {QC176},
        Chapter = {3},
        Date-Added = {2008-12-22 16:15:28 -0500},
        Date-Modified = {2008-12-25 15:57:59 -0500},
        Dewey-Call-Number = {530.4/1},
        Genre = {Solid state physics},
        Isbn = {0030839939},
        Library-Id = {74009772},
        Publisher = {Holt, Rinehart and Winston},
        Title = {Solid state physics},
        Year = {1976}}

@article{Ngai81,
        Author = {K.~L. Ngai and F.-S. Liu},
        Date-Added = {2008-12-22 15:52:33 -0500},
        Date-Modified = {2009-01-25 21:10:28 -0500},
        Journal = {Phys. Rev. B},
        Pages = {1049-1065},
        Title = {Dispersive diffusion transport and noise,                   time-dependent diffusion coefficient, generalized                   Einstein-Nernst relation, and dispersive                   diffusion-controlled unimolecular and bimolecular                   reactions},
        Volume = 24,
        Year = 1981}

@article{Tolman20,
        Author = {R. C. Tolman},
        Date-Added = {2008-12-22 15:45:10 -0500},
        Date-Modified = {2009-01-25 21:12:43 -0500},
        Journal = {J. Am. Chem. Soc.},
        Pages = 2506,
        Title = {Statistical Mechanics Applied to Chemical Kinetics},
        Volume = 42,
        Year = 1920}

@book{Tolman27,
        Address = {New York},
        Author = {R. C. Tolman},
        Date-Added = {2008-12-22 15:45:10 -0500},
        Date-Modified = {2008-12-22 15:45:10 -0500},
        Pages = {260-270},
        Publisher = {Chemical Catalog Co.},
        Title = {Statistical Mechanics with Applications to Physics and Chemistry},
        Year = 1927}

@article{Truhlar78,
        Author = {Donald G. Truhlar},
        Date-Added = {2008-12-22 15:44:46 -0500},
        Date-Modified = {2008-12-22 15:44:46 -0500},
        Journal = {J. Chem. Ed.},
        Pages = 309,
        Title = {Interpretation of the Activation Energy},
        Volume = 55,
        Year = 1978}

@unpublished{Truhlar00,
        Author = {D.~G. Truhlar and A. Kohen},
        Date-Added = {2008-12-22 15:44:46 -0500},
        Date-Modified = {2008-12-22 15:44:46 -0500},
        Note = {private correspondence}}

@article{Liu92,
        Author = {R.~S. Liu and D.~W. Qi and S. Wang},
        Date-Added = {2008-12-22 15:44:22 -0500},
        Date-Modified = {2009-01-25 21:12:05 -0500},
        Journal = {Phys. Rev. B},
        Pages = {451-453},
        Title = {Subpeaks of structure factors for rapidly quenched metals},
        Volume = 45,
        Year = 1992}

@article{Lewis91,
        Author = {L.~J. Lewis},
        Date-Added = {2008-12-22 15:43:19 -0500},
        Date-Modified = {2009-01-25 21:11:37 -0500},
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        Year = {1999}}

@article{Gezelter99,
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        Title = {Reply to `Comment on ``Direct Observation of                   Stretched-Exponential Relaxation in Low-Temperature                   Lennard-Jones Systems Using th eCage Correlation                   Function'' '},
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        Year = 1999}

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        Title = {Theory of Simple Liquids},
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@article{Stillinger98,
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@article{Zhu:1997lr,
        Abstract = {Experimental bulk mixing data on disordered bimetallics of Ni, Cu, Rh, Pd, Ag, Ir, Pt, and Au are used to parametrize the recently developed {$\backslash$}underline{\{}b{\}}ond {$\backslash$}underline{\{}o{\}}rder metal {$\backslash$}underline{\{}s{\}}imulator (BOS-mixing) model, including a full error analysis. This model characterizes the variation of metal-metal bond strength with number and type of atomic neighbors. The model is shown to accurately fit experimental mixing energy curves as a function of composition irrespective of whether the curves are symmetric or asymmetric around the 50{\%} value. As an illustration of the utility of the BOS-mixing model, we predict the microstructures of bimetallic clusters with 201 atoms (or 61{\%} dispersion) and a composition of 50{\%}-50{\%}. The examples demonstrate how differences in surface energy, mixing energy, and mixing entropy either compete or cooperate in determining the microstructure of small bimetallic clusters.},
        Author = {Zhu, Ling and DePristo, Andrew E.},
        Date-Added = {2007-10-03 14:57:41 -0400},
        Date-Modified = {2009-01-25 21:47:18 -0500},
        Journal = {J.  Catal.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/sdarticle2.pdf},
        Number = {2},
        Pages = {400-407},
        Title = {Microstructures of Bimetallic Clusters: Bond Order Metal Simulator for Disordered Alloys},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6WHJ-45KMYC8-80/2/0c7f43e48e4dfa1206cb717c85db1972},
        Volume = {167},
        Year = {1997},
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQGMAAAAAAGMAAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFCOEOc2RhcnRpY2xlMi5wZGYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUt6cMpXnYAAAAAAAAAAAABAAIAAAkgAAAAAAAAAAAAAAAAAAAABlBhcGVycwAQAAgAAMQdu44AAAARAAgAAMMplrYAAAABABAABQjhAAMP9wADD+AAAHmOAAIAOk1hY2ludG9zaCBIRDpVc2VyczpjaGFybGVzOkRvY3VtZW50czpQYXBlcnM6c2RhcnRpY2xlMi5wZGYADgAeAA4AcwBkAGEAcgB0AGkAYwBsAGUAMgAuAHAAZABmAA8AGgAMAE0AYQBjAGkAbgB0AG8AcwBoACAASABEABIALVVzZXJzL2NoYXJsZXMvRG9jdW1lbnRzL1BhcGVycy9zZGFydGljbGUyLnBkZgAAEwABLwAAFQACAA7//wAA0h4fICFYJGNsYXNzZXNaJGNsYXNzbmFtZaMhIiNdTlNNdXRhYmxlRGF0YVZOU0RhdGFYTlNPYmplY3RfEBguLi9QYXBlcnMvc2RhcnRpY2xlMi5wZGbSHh8mJ6InI1xOU0RpY3Rpb25hcnkACAARABoAHwApADIANwA6AD8AQQBTAFwAYgBpAHAAeACDAIUAiACKAIwAjwCRAJMAnQCqAK8AtwC5AkkCTgJXAmICZgJ0AnsChAKfAqQCpwAAAAAAAAIBAAAAAAAAACgAAAAAAAAAAAAAAAAAAAK0},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6WHJ-45KMYC8-80/2/0c7f43e48e4dfa1206cb717c85db1972}}

@article{MainardiD.S._la0014306,
        Affiliation = {Department of Chemical Engineering, University of South Carolina, Columbia, South Carolina 29208},
        Author = {Mainardi, D.S. and Balbuena, P.B.},
        Date-Added = {2007-10-03 14:53:26 -0400},
        Date-Modified = {2009-01-08 18:43:38 -0500},
        Issn = {0743-7463},
        Journal = {Langmuir},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/la0014306.pdf},
        Number = {6},
        Pages = {2047-2050},
        Title = {Monte Carlo Simulation of {C}u-{N}i Nanoclusters: Surface Segregation Studies},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/la0014306},
        Volume = {17},
        Year = {2001},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/la0014306}}

@article{nose:1803,
        Author = {Shuichi Nose and Fumiko Yonezawa},
        Date-Added = {2007-09-21 13:00:58 -0400},
        Date-Modified = {2009-01-25 21:45:59 -0500},
        Doi = {10.1063/1.450427},
        Journal = {J. Chem. Phys.},
        Keywords = {LENNARDJONES POTENTIAL; COMPUTERIZED SIMULATION; MELTING; CRYSTALLIZATION; MOLECULAR DYNAMICS CALCULATION; LIQUID STRUCTURE; NUCLEATION; MATHEMATICAL MODELS},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_84_1803.pdf},
        Number = {3},
        Pages = {1803-1814},
        Publisher = {AIP},
        Title = {Isothermal--isobaric computer simulations of melting and crystallization of a Lennard-Jones system},
        Url = {http://link.aip.org/link/?JCP/84/1803/1},
        Volume = {84},
        Year = {1986},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/84/1803/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.450427}}

@article{hsu:4974,
        Author = {C. S. Hsu and Aneesur Rahman},
        Date-Added = {2007-09-21 12:52:21 -0400},
        Date-Modified = {2009-01-25 21:56:20 -0500},
        Doi = {10.1063/1.438311},
        Journal = {J. Chem. Phys.},
        Keywords = {NUCLEATION; SYMMETRY; INTERATOMIC FORCES; RUBIDIUM; LENNARD=(HYPHEN)=JONES POTENTIAL; CORRELATIONS; CRYSTALS},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_71_4974.pdf},
        Number = {12},
        Pages = {4974-4986},
        Publisher = {AIP},
        Title = {Interaction potentials and their effect on crystal nucleation and symmetry},
        Url = {http://link.aip.org/link/?JCP/71/4974/1},
        Volume = {71},
        Year = {1979},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/71/4974/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.438311}}

@article{PhysRevLett.53.1951,
        Author = {Shechtman, D. and Blech, I. and Gratias, D. and Cahn, J. W.},
        Date-Added = {2007-09-20 17:44:19 -0400},
        Date-Modified = {2007-09-20 17:44:57 -0400},
        Doi = {10.1103/PhysRevLett.53.1951},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/p1951_1.pdf},
        Month = {Nov},
        Number = {20},
        Numpages = {2},
        Pages = {1951--1953},
        Publisher = {American Physical Society},
        Title = {Metallic Phase with Long-Range Orientational Order and No Translational Symmetry},
        Volume = {53},
        Year = {1984},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.53.1951}}

@article{PhysRevLett.56.1168,
        Author = {Stephens, Peter W. and Goldman, Alan I.},
        Date-Added = {2007-09-20 17:35:02 -0400},
        Date-Modified = {2007-09-20 17:35:08 -0400},
        Doi = {10.1103/PhysRevLett.56.1168},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/p1168_1.pdf},
        Month = {Mar},
        Number = {11},
        Numpages = {3},
        Pages = {1168--1171},
        Publisher = {American Physical Society},
        Title = {Sharp Diffraction Maxima from an Icosahedral Glass},
        Volume = {56},
        Year = {1986},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.56.1168}}

@article{HOARE:1976fk,
        Author = {HOARE, M},
        Date-Added = {2007-09-20 16:52:33 -0400},
        Date-Modified = {2007-09-20 16:52:37 -0400},
        Journal = {Annals of the New York Academy of Sciences},
        Pages = {186-207},
        Title = {STABILITY AND LOCAL ORDER IN SIMPLE AMORPHOUS PACKINGS},
        Volume = {279},
        Year = {1976}}

@article{19871127,
        Abstract = {Numerous examples of metallic alloys have been discovered, the atomic structures of which display an icosahedral symmetry that is impossible for ordinary periodic crystals. Recent experimental results support the hypothesis that the alloys are examples of a new ``quasicrystal'' phase of solid matter. Observed deviations from an ideal quasicrystal structure can be explained as ``phason strains,'' a special class of defects predicted to be the dominant type of imperfection formed during solidification.},
        Author = {Steinhardt, Paul J.},
        Copyright = {Copyright 1987 American Association for the Advancement of Science},
        Date-Added = {2007-09-20 15:31:29 -0400},
        Date-Modified = {2007-09-20 15:31:36 -0400},
        Issn = {0036-8075},
        Journal = {Science},
        Jstor_Articletype = {Full Length Article},
        Jstor_Date = {19871127},
        Jstor_Formatteddate = {Nov. 27, 1987},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/steinhart_science.pdf},
        Month = {nov},
        Number = {4831},
        Pages = {1242--1247},
        Publisher = {American Association for the Advancement of Science},
        Series = {3},
        Title = {Icosahedral Solids: A New Phase of Matter?},
        Url = {http://links.jstor.org/sici?sici=0036-8075%2819871127%293%3A238%3A4831%3C1242%3AISANPO%3E2.0.CO%3B2-I},
        Volume = {238},
        Year = {1987},
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        Bdsk-Url-1 = {http://links.jstor.org/sici?sici=0036-8075(19871127)3:238:4831%3C1242:ISANPO%3E2.0.CO;2-I}}

@article{Waal:1995lr,
        Abstract = {It is proposed that the splitting of the second peak of the total static structure factor, S(k), of many metallic glasses is essentially the same feature as the indentation at k{$[$}sigma{$]$} = (9/2){$[$}pi{$]$} in the function (sin k {$[$}sigma{$]$} + {$[$}alpha{$]$}-1 sin k{$[$}alpha{$]$}{$[$}sigma{$]$}), caused by the coincidence of the fourth minimum of the second term with the third maximum of the first term when {$[$}alpha{$]$} {$[$}approximate{$]$} 5/3. Together with the strong-weak relation of the split peak components of S(k), this feature indicates the splitting to be direct evidence for face-sharing of regular tetrahedra ({$[$}alpha{$]$} = 2{$[$}square root{$]$}2/3) dominating the topological short range order; increasing the number of face-sharing tetrahedra in local structural units indeed increases the amount of peak splitting in S(k); a dense random packing of well defined identical structural units (DRPSU), with neighbouring units linked together by a shared icosahedron, is described in detail. The packing fraction in a homogeneous, isotropic 1078-atom model is 0.67, after static relaxation under a two-body Lennard-Jones potential.},
        Author = {van de Waal, Benjamin W.},
        Date-Added = {2007-09-20 13:17:52 -0400},
        Date-Modified = {2009-01-25 21:32:15 -0500},
        Journal = {J Non-Cryst. Solids},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/sdarticle1.pdf},
        Number = {1-2},
        Pages = {118--128},
        Title = {On the origin of second-peak splitting in the static structure factor of metallic glasses},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TXM-3YB50T0-Y/2/cfc3dd6cbf53b26af1daf9cddb6dd2e3},
        Volume = {189},
        Year = {1995},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TXM-3YB50T0-Y/2/cfc3dd6cbf53b26af1daf9cddb6dd2e3}}

@article{turnbull:411,
        Author = {David Turnbull},
        Date-Added = {2007-09-19 16:54:15 -0400},
        Date-Modified = {2007-09-19 16:58:15 -0400},
        Doi = {10.1063/1.1700435},
        Journal = {The Journal of Chemical Physics},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_20_411.pdf},
        Number = {3},
        Pages = {411-424},
        Publisher = {AIP},
        Title = {Kinetics of Solidification of Supercooled Liquid Mercury Droplets},
        Url = {http://link.aip.org/link/?JCP/20/411/1},
        Volume = {20},
        Year = {1952},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/20/411/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1700435}}

@article{235821,
        Address = {New York, NY, USA},
        Author = {C. Bradford Barber and David P. Dobkin and Hannu Huhdanpaa},
        Date-Added = {2007-09-18 19:11:42 -0400},
        Date-Modified = {2007-09-18 19:11:50 -0400},
        Doi = {http://doi.acm.org/10.1145/235815.235821},
        Issn = {0098-3500},
        Journal = {ACM Trans. Math. Softw.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/p469-barber.pdf},
        Number = {4},
        Pages = {469--483},
        Publisher = {ACM Press},
        Title = {The quickhull algorithm for convex hulls},
        Volume = {22},
        Year = {1996},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://doi.acm.org/10.1145/235815.235821}}

@article{0031-9155-41-9-016,
        Abstract = {Volume measurements are useful in many branches of science and medicine. They are usually accomplished by acquiring a sequence of cross sectional images through the object using an appropriate scanning modality, for example x-ray computed tomography (CT), magnetic resonance (MR) or ultrasound (US). In the cases of CT and MR, a dividing cubes algorithm can be used to describe the surface as a triangle mesh. However, such algorithms are not suitable for US data, especially when the image sequence is multiplanar (as it usually is). This problem may be overcome by manually tracing regions of interest (ROIs) on the registered multiplanar images and connecting the points into a trianglar mesh. In this paper we describe and evaluate a new discreet form of Gauss' theorem which enables the calculation of the volume of any enclosed surface described by a triangular mesh. The volume is calculated by summing the vector product of the centroid, area and normal of each surface triangle. The algorithm was tested on computer-generated objects, US-scanned balloons, livers and kidneys and CT-scanned clay rocks. The results, expressed as the mean percentage difference one standard deviation were , , and \% for balloons, livers, kidneys and rocks respectively. The results compare favourably with other volume estimation methods such as planimetry and tetrahedral decomposition.},
        Author = {S W Hughes, T J D'Arcy, D J Maxwell, J E Saunders, C F Ruff, W S C Chiu and R J Sheppard},
        Date-Added = {2007-09-18 18:49:49 -0400},
        Date-Modified = {2007-09-18 18:49:55 -0400},
        Journal = {Physics in Medicine and Biology},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/m60915.pdf},
        Number = {9},
        Pages = {1809-1821},
        Title = {Application of a new discreet form of Gauss' theorem for measuring volume},
        Url = {http://stacks.iop.org/0031-9155/41/1809},
        Volume = {41},
        Year = {1996},
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@article{Balucani:1990fk,
        Author = {Balucani, U. and Vallauri, R.},
        Date-Added = {2007-09-18 11:47:47 -0400},
        Date-Modified = {2007-09-18 11:48:01 -0400},
        Journal = {Chemical Physics Letters},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/sdarticle0.pdf},
        Number = {1},
        Pages = {77--81},
        Title = {Evolution of bond-angle distribution from liquid to glassy states},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TFN-44XDV0S-9H/2/fa1467fe68d6474b775de0f4cfd7f7ab},
        Volume = {166},
        Year = {1990},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TFN-44XDV0S-9H/2/fa1467fe68d6474b775de0f4cfd7f7ab}}

@article{Sheng:2006lr,
        Annote = {10.1038/nature04421},
        Author = {Sheng, H. W. and Luo, W. K. and Alamgir, F. M. and Bai, J. M. and Ma, E.},
        Date-Added = {2007-09-17 12:50:02 -0400},
        Date-Modified = {2007-09-17 12:50:07 -0400},
        Isbn = {0028-0836},
        Journal = {Nature},
        L3 = {http://www.nature.com/nature/journal/v439/n7075/suppinfo/nature04421_S1.html},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/nature04421.pdf},
        M3 = {10.1038/nature04421},
        Number = {7075},
        Pages = {419--425},
        Title = {Atomic packing and short-to-medium-range order in metallic glasses},
        Ty = {JOUR},
        Url = {http://dx.doi.org/10.1038/nature04421},
        Volume = {439},
        Year = {2006},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1038/nature04421}}

@article{19521106,
        Author = {Frank, F. C.},
        Copyright = {Copyright 1952 The Royal Society},
        Date-Added = {2007-09-17 12:26:50 -0400},
        Date-Modified = {2007-09-17 12:26:56 -0400},
        Group = {A Discussion on Theory of Liquids},
        Issn = {0080-4630},
        Journal = {Proceedings of the Royal Society of London. Series A, Mathematical and Physical Sciences},
        Jstor_Articletype = {Full Length Article},
        Jstor_Date = {19521106},
        Jstor_Formatteddate = {Nov. 6, 1952},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/frank_icos_liq.pdf},
        Month = {nov},
        Number = {1120},
        Pages = {43--46},
        Publisher = {The Royal Society},
        Title = {Supercooling of Liquids},
        Url = {http://links.jstor.org/sici?sici=0080-4630%2819521106%29215%3A1120%3C43%3ASOL%3E2.0.CO%3B2-9},
        Volume = {215},
        Year = {1952},
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        Bdsk-Url-1 = {http://links.jstor.org/sici?sici=0080-4630(19521106)215:1120%3C43:SOL%3E2.0.CO;2-9}}

@article{PhysRevLett.91.135505,
        Author = {Di Cicco, Andrea and Trapananti, Angela and Faggioni, Silena and Filipponi, Adriano},
        Date-Added = {2007-09-17 12:15:58 -0400},
        Date-Modified = {2007-09-17 12:16:09 -0400},
        Doi = {10.1103/PhysRevLett.91.135505},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/e135505.pdf},
        Month = {Sep},
        Number = {13},
        Numpages = {4},
        Pages = {135505},
        Publisher = {American Physical Society},
        Title = {Is There Icosahedral Ordering in Liquid and Undercooled Metals?},
        Volume = {91},
        Year = {2003},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.91.135505}}

@article{duijneveldt:4655,
        Author = {J. S. van Duijneveldt and D. Frenkel},
        Date-Added = {2007-09-13 16:50:13 -0400},
        Date-Modified = {2009-01-25 21:46:29 -0500},
        Doi = {10.1063/1.462802},
        Journal = {J. Chem. Phys.},
        Keywords = {COMPUTERIZED SIMULATION; FREE ENERGY; CRYSTALS; NUCLEATION; THERMAL BARRIERS; MONTE CARLO METHOD; SUPERCOOLED LIQUIDS; FCC LATTICES; BCC LATTICES; SIMULATION; HOMOGENEITY},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_96_4655.pdf},
        Number = {6},
        Pages = {4655-4668},
        Publisher = {AIP},
        Title = {Computer simulation study of free energy barriers in crystal nucleation},
        Url = {http://link.aip.org/link/?JCP/96/4655/1},
        Volume = {96},
        Year = {1992},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/96/4655/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.462802}}

@article{Jiang:2005lr,
        Author = {Hongjin Jiang and Kyoung-sik Moon and Wong, C. P.},
        Date-Added = {2007-09-11 14:55:57 -0400},
        Date-Modified = {2007-09-11 14:56:06 -0400},
        Isbn = {1550-5723},
        Journal = {Advanced Packaging Materials: Processes, Properties and Interfaces, 2005. Proceedings. International Symposium on},
        Journal1 = {Advanced Packaging Materials: Processes, Properties and Interfaces, 2005. Proceedings. International Symposium on},
        Keywords = {adhesives; conducting polymers; copper alloys; filled polymers; filler metals; integrated circuit interconnections; materials preparation; nanoparticles; powder technology; powders; silver alloys; Ag-Cu alloy nanoparticle synthesis; AgCu; TEM observation; UV absorption; conductive filler; electrically conductive adhesive; lead-free interconnect material; mixed alloy structure; polyol process; silver-copper alloy},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/01432072.pdf},
        Pages = {173--177},
        Title = {Synthesis of Ag-Cu alloy nanoparticles for lead-free interconnect materials},
        Title1 = {Advanced Packaging Materials: Processes, Properties and Interfaces, 2005. Proceedings. International Symposium on},
        Ty = {CONF},
        Year = {2005},
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@unpublished{hartlandPrv2007,
        Author = {G. V. Hartland},
        Date-Added = {2007-09-10 16:28:58 -0400},
        Date-Modified = {2007-09-10 16:34:05 -0400},
        Howpublished = {(private communication)},
        Note = {Private Communication},
        Title = {Interfacial Conductance for Nanoparticles}}

@article{xuan:043507,
        Author = {Yimin Xuan and Qiang Li and Xing Zhang and Motoo Fujii},
        Date-Added = {2007-09-10 16:25:23 -0400},
        Date-Modified = {2007-09-10 16:26:01 -0400},
        Doi = {10.1063/1.2245203},
        Eid = {043507},
        Journal = {Journal of Applied Physics},
        Keywords = {nanoparticles; suspensions; stochastic processes; Brownian motion; heat transfer; thermal conductivity; two-phase flow},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JApplPhys_100_043507.pdf},
        Number = {4},
        Numpages = {6},
        Pages = {043507},
        Publisher = {AIP},
        Title = {Stochastic thermal transport of nanoparticle suspensions},
        Url = {http://link.aip.org/link/?JAP/100/043507/1},
        Volume = {100},
        Year = {2006},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JAP/100/043507/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.2245203}}

@article{Henglein:1999fk,
        Abstract = {Colloidal silver sols of long-time stability are formed in the gamma-irradiation of 1.0 x 10(-4) M AgClO4 solutions, which also contain 0.3 M 2-propanol, 2.5 x 10(-2) M N2O, and sodium citrate in various concentrations. The reduction of Ag+ in these solutions is brought about by the I-hydroxyalkyl radical generated in the radiolysis of 2-propanol; citrate does not act as a reductant but solely as a stabilizer of the colloidal particles formed. Its concentration is varied in the range from 5.0 x 10(-5) to 1.5 x 10(-3) M, and the size and size distribution of the silver particles are studied by electron microscopy. At low citrate concentration, partly agglomerated large particles are formed that have many imperfections. In an intermediate range (a few 10(-4) M), well-separated particles with a rather narrow size distribution and little imperfections are formed, the size slightly decreasing with increasing citrate concentration. At high citrate concentrations, large lumps of coalesced silver particles are present, due to destabilization by the high ionic strength of the solution. These findings are explained by two growth mechanisms: condensation of small silver clusters (type-I growth), and reduction of Ag+ on silver particles via radical-to-particle electron transfer (type-II growth). The particles formed in the intermediate range of citrate concentration were studied by high-resolution electron microscopy and computer simulations. They constitute icosahedra and cuboctahedra.},
        Author = {Henglein, A and Giersig, M},
        Date-Added = {2007-09-07 18:11:39 -0400},
        Date-Modified = {2007-09-07 18:17:03 -0400},
        Journal = {Journal of Physical Chemistry B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp9925334.pdf},
        Pages = {9533-9539},
        Title = {Formation of colloidal silver nanoparticles: Capping action of citrate},
        Volume = {103},
        Year = {1999},
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@article{Link:2000lr,
        Abstract = {Driven by the search for new materials with interesting and unique properties and also by the fundamental question of how atomic and molecular physical behaviour develops with increasing size, the field of nanoparticle research has grown immensely in the last two decades. Partially for these reasons, colloidal solutions of metallic (especially silver and gold) nanoparticles have long fascinated scientists because of their very intense colours. The intense red colour of colloidal gold nanoparticles is due to their surface plasmon absorption. This article describes the physical origin of the surface plasmon absorption in gold nanoparticles with emphasis on the Mie and also the Maxwell-Garnett theory and reviews the effects of particle size and shape on the resonance condition. A better understanding of the relationship between the optical absorption spectrum (in particular, the plasmon resonance) and such particle properties as its dimensions or surrounding environment can prove fruitful for the use of the plasmon absorption as an analytical tool. The plasmon resonance has also had a great impact on the Raman spectrum of surface-adsorbed molecules and a large enhancement of the fluorescence quantum yield of gold nanorods is observed. Furthermore, following the changes in the plasmon absorption induced by excitation (heating) with ultrashort laser pulses allows one to monitor the electron dynamics (electron-electron and electron-phonon interactions) in real time, which is important in understanding such fundamental questions regarding the thermal and electrical conductivity of these nanoparticles. Very intense heating with laser pulses leads to structural changes of the nanoparticles (nuclear rearrangements in the form of melting and fragmentation). ABSTRACT FROM AUTHOR Copyright of International Reviews in Physical Chemistry is the property of Taylor \& Francis Ltd and its content may not be copied or emailed to multiple sites or posted to a listserv without the copyright holder's express written permission. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract. (Copyright applies to all Abstracts)},
        Abstract1 = {Driven by the search for new materials with interesting and unique properties and also by the fundamental question of how atomic and molecular physical behaviour develops with increasing size, the field of nanoparticle research has grown immensely in the last two decades. Partially for these reasons, colloidal solutions of metallic (especially silver and gold) nanoparticles have long fascinated scientists because of their very intense colours. The intense red colour of colloidal gold nanoparticles is due to their surface plasmon absorption. This article describes the physical origin of the surface plasmon absorption in gold nanoparticles with emphasis on the Mie and also the Maxwell-Garnett theory and reviews the effects of particle size and shape on the resonance condition. A better understanding of the relationship between the optical absorption spectrum (in particular, the plasmon resonance) and such particle properties as its dimensions or surrounding environment can prove fruitful for the use of the plasmon absorption as an analytical tool. The plasmon resonance has also had a great impact on the Raman spectrum of surface-adsorbed molecules and a large enhancement of the fluorescence quantum yield of gold nanorods is observed. Furthermore, following the changes in the plasmon absorption induced by excitation (heating) with ultrashort laser pulses allows one to monitor the electron dynamics (electron-electron and electron-phonon interactions) in real time, which is important in understanding such fundamental questions regarding the thermal and electrical conductivity of these nanoparticles. Very intense heating with laser pulses leads to structural changes of the nanoparticles (nuclear rearrangements in the form of melting and fragmentation). ABSTRACT FROM AUTHOR Copyright of International Reviews in Physical Chemistry is the property of Taylor \& Francis Ltd and its content may not be copied or emailed to multiple sites or posted to a listserv without the copyright holder's express written permission. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract. (Copyright applies to all Abstracts)},
        Annote = {Accession Number: 3844873; Link, Stephan 1 El-Sayed, Mostafa A. 1; Affiliations:  1: Laser Dynamics Laboratory, School of Chemistry and Biochemistry, Georgia Institute of Technology, Atlanta, GA 30332-0400, USA; Source Information: Jul/Sep2000, Vol. 19 Issue 3, p409; Subject Term: MOLECULAR structure; Subject Term: NANOPARTICLES; Number of Pages: 45p; Document Type: Article},
        Author = {Link, Stephan and El-Sayed, Mostafa A.},
        Date-Added = {2007-09-07 16:21:48 -0400},
        Date-Modified = {2007-09-07 16:21:55 -0400},
        Isbn = {0144235X},
        J1 = {International Reviews in Physical Chemistry},
        Journal = {International Reviews in Physical Chemistry},
        Journal1 = {International Reviews in Physical Chemistry},
        Keywords = {MOLECULAR structure; NANOPARTICLES},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/3844873.pdf},
        M3 = {Article},
        Number = {3},
        Pages = {409--453},
        Publisher = {Taylor \& Francis Ltd},
        Title = {Shape and size dependence of radiative, non-radiative and photothermal properties of gold nanocrystals.},
        Ty = {JOUR},
        Url = {http://search.ebscohost.com/login.aspx?direct=true&AuthType=ip,url,uid,cookie&db=afh&AN=3844873&site=ehost-live},
        Volume = {19},
        Year = {2000},
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@article{BROOKS:1985kx,
        Author = {Brooks, CL and Brunger, A and Karplus, M},
        Date-Added = {2007-09-06 15:55:51 -0400},
        Date-Modified = {2009-01-25 20:58:23 -0500},
        Journal = {Biopolymers},
        Pages = {843-865},
        Title = {ACTIVE-SITE DYNAMICS IN PROTEIN MOLECULES - A STOCHASTIC BOUNDARY MOLECULAR-DYNAMICS APPROACH},
        Volume = {24},
        Year = {1985}}

@article{BRUNGER:1984fj,
        Author = {Brunger, A and Brooks, CL and Karplus, M},
        Date-Added = {2007-09-06 15:55:51 -0400},
        Date-Modified = {2009-01-25 20:58:54 -0500},
        Journal = {Chem. Phys. Lett.},
        Pages = {495-500},
        Title = {STOCHASTIC BOUNDARY-CONDITIONS FOR MOLECULAR-DYNAMICS SIMULATIONS OF ST2 WATER},
        Volume = {105},
        Year = {1984}}

@article{BROOKS:1983uq,
        Author = {Brooks CL and Karplus, M},
        Date-Added = {2007-09-06 15:55:51 -0400},
        Date-Modified = {2009-01-25 20:57:56 -0500},
        Journal = {J. Chem. Phys.},
        Pages = {6312-6325},
        Title = {DEFORMABLE STOCHASTIC BOUNDARIES IN MOLECULAR-DYNAMICS},
        Volume = {79},
        Year = {1983}}

@book{Strandburg:1992qy,
        Address = {New York},
        Annote = {LDR    01152pam  2200301 a 4500
001    2960109
005    19920314112708.5
008    910605s1992    nyua     b    001 0 eng  
035    $9(DLC)   91020237
906    $a7$bcbc$corignew$d1$eocip$f19$gy-gencatlg
955    $apc17 to ea00 06-05-91; ea27 to SCD 06-05-91; fg08 06-06-91; fm27 6-11-91; CIP ver. bc27 03-07-92; to SL 03-14-92
010    $a   91020237 
020    $a0387976388 (U.S. : alk. paper)
020    $a3540976388
040    $aDLC$cDLC$dDLC
050 00 $aQC173.4.C65$bB66 1992
082 00 $a530.4/1$220
245 00 $aBond-orientational order in condensed matter systems /$cKatherine J. Strandburg, editor ; foreword by David R. Nelson.
260    $aNew York :$bSpringer-Verlag,$c1992.
300    $axi, 388 p. :$bill. ;$c25 cm.
440  0 $aPartially ordered systems
504    $aIncludes bibliographical references and index.
650  0 $aCondensed matter.
650  0 $aCrystals.
650  0 $aGlass.
650  0 $aPhase transformations (Statistical physics)
700 1  $aStrandburg, Katherine Jo,$d1957-
991    $bc-GenColl$hQC173.4.C65$iB66 1992$p00036991264$tCopy 1$wBOOKS
},
        Author = {Strandburg, Katherine Jo},
        Call-Number = {QC173.4.C65},
        Date-Added = {2007-09-06 15:29:04 -0400},
        Date-Modified = {2007-09-06 15:29:37 -0400},
        Dewey-Call-Number = {530.4/1},
        Genre = {Condensed matter},
        Isbn = {0387976388 (U.S. : alk. paper)},
        Library-Id = {91020237},
        Publisher = {Springer-Verlag},
        Title = {Bond-orientational order in condensed matter systems},
        Year = {1992}}

@book{Kittel:1996fk,
        Address = {New York},
        Annote = {LDR    01170cam  2200289 a 4500
001    1143187
005    20060719213349.0
008    950426s1996    nyua     b    001 0 eng  
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955    $apc01 to JA00 04-26-95; je39 04-27-95; je05 to DDC 04-27-95; CIP ver. pv08 07-27-95
035    $9(DLC)   95018445
010    $a   95018445 
020    $a0471111813 (alk. paper)
040    $aDLC$cDLC$dDLC
050 00 $aQC176$b.K5 1996
082 00 $a530.4/1$220
100 1  $aKittel, Charles.
245 10 $aIntroduction to solid state physics /$cCharles Kittel.
250    $a7th ed.
260    $aNew York :$bWiley,$cc1996.
300    $axi, 673 p. :$bill. ;$c25 cm.
504    $aIncludes bibliographical references and index.
650  0 $aSolid state physics.
856 42 $3Publisher description$uhttp://www.loc.gov/catdir/description/wiley033/95018445.html
856 4  $3Table of Contents only$uhttp://www.loc.gov/catdir/toc/onix03/95018445.html
856 42 $3Contributor biographical information$uhttp://www.loc.gov/catdir/enhancements/fy0607/95018445-b.html
991    $bc-GenColl$hQC176$i.K5 1996$p00035929873$tCopy 1$wBOOKS
},
        Author = {Kittel, Charles},
        Call-Number = {QC176},
        Date-Added = {2007-09-06 15:23:29 -0400},
        Date-Modified = {2007-09-06 15:25:11 -0400},
        Dewey-Call-Number = {530.4/1},
        Edition = {7th ed},
        Genre = {Solid state physics},
        Isbn = {0471111813 (alk. paper)},
        Library-Id = {95018445},
        Publisher = {Wiley},
        Title = {Introduction to solid state physics},
        Url = {http://www.loc.gov/catdir/description/wiley033/95018445.html},
        Year = {1996},
        Bdsk-Url-1 = {http://www.loc.gov/catdir/description/wiley033/95018445.html}}

@misc{Hartland:2003lr,
        Abstract = {Laser excitation of metal nanoparticles can provide enough energy to melt or even fragment the particles. In this article we describe some recent experiments where controlled laser excitation was used to transform core-shell bimetallic particles into the corresponding alloy. Results for Au-Ag particles in solution and in a thin film are presented. Details are given about the excitation energies needed for alloying and how interdiffusion and alloying occur in nanoparticles. The spectral and dynamical properties of bimetallic particles are also discussed - especially as they pertain to our experiments.},
        Author = {Hartland, GV and Guillaudeu, S and Hodak, JH},
        Date-Added = {2007-09-06 15:19:25 -0400},
        Date-Modified = {2007-09-06 15:19:59 -0400},
        Note = {Molecules As Components of Electronic Devices},
        Pages = {106-122},
        Series = {ACS SYMPOSIUM SERIES},
        Title = {Laser-induced alloying in metal nanoparticles: Controlling spectral properties with light},
        Volume = {844},
        Year = {2003}}

@article{HengleinA._jp992950g,
        Affiliation = {Radiation Laboratory, University of Notre Dame, Notre Dame, Indiana 46556},
        Author = {Henglein, A.},
        Date-Added = {2007-09-06 15:01:20 -0400},
        Date-Modified = {2009-01-25 21:42:39 -0500},
        Issn = {1520-6106},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp992950g.pdf},
        Number = {6},
        Pages = {1206-1211},
        Title = {Formation and Absorption Spectrum of Copper Nanoparticles from the Radiolytic Reduction of {C}u({CN})2-},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp992950g},
        Volume = {104},
        Year = {2000},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp992950g}}

@article{Petrova:2007qy,
        Abstract = {This paper describes our recent time-resolved spectroscopy studies of the properties of gold particles at high laser excitation levels. In these experiments, an intense pump laser pulse rapidly heats the particle, creating very high lattice temperatures - up to the melting point of bulk gold. These high temperatures can have dramatic effects on the particle and the surroundings. The lattice temperature created is determined by observing the coherently excited the vibrational modes of the particles. The periods of these modes depend on temperature, thus, they act as an internal thermometer. We have used these experiments to provide values for the threshold temperatures for explosive boiling of the solvent surrounding the particles, and laser induced structural transformations in non-spherical particles. The results of these experiments are relevant to the use of metal nanoparticles in photothermal therapy, where laser induced heating is used to selectively kill cells.},
        Author = {Petrova, Hristina and Hu, Min and Hartland, Gregory V.},
        Date-Added = {2007-09-06 14:47:57 -0400},
        Date-Modified = {2007-09-06 14:49:36 -0400},
        Doi = {DOI 10.1524/zpch.2007.221.3.361},
        Journal = {Zeitschrift Fur Physikalische Chemie-International Journal of Research In Physical Chemistry \& Chemical Physics},
        Keywords = {metal nanoparticles; phonon modes; photothermal properties; laser-induced heating},
        Pages = {361-376},
        Title = {Photothermal properties of gold nanoparticles},
        Volume = {221},
        Year = {2007},
        Bdsk-Url-1 = {http://dx.doi.org/10.1524/zpch.2007.221.3.361}}

@article{Hartland:2004fk,
        Author = {Gregory V. Hartland},
        Date-Added = {2007-09-06 14:34:21 -0400},
        Date-Modified = {2007-09-06 14:37:40 -0400},
        Journal = {Physical Chemistry Chemical Physics},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/b413368d.pdf},
        Number = {23},
        Pages = {5263-5274},
        Title = {Measurements of the material properties of metal nanoparticles by time-resolved spectroscopy},
        Volume = {6},
        Year = {2004},
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@article{Qi:2001nn,
        Author = {Yue Qi and Tahir Cagin and William L. Johnson and William A. Goddard III},
        Date-Added = {2007-09-06 13:34:45 -0400},
        Date-Modified = {2009-01-25 21:44:04 -0500},
        Journal = {J. Chem. Phys.},
        Keywords = {melting; freezing; crystallisation; nickel; nanostructured materials; metal clusters},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Qi/2001.pdf},
        Number = {1},
        Pages = {385-394},
        Publisher = {AIP},
        Title = {Melting and crystallization in Ni nanoclusters: The mesoscale regime},
        Url = {http://link.aip.org/link/?JCP/115/385/1},
        Volume = {115},
        Year = {2001},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/115/385/1}}

@article{Cleveland:1997jb,
        Author = {Charles L. Cleveland and Uzi Landman and Thomas G. Schaaff and Marat N. Shafigullin and Peter W. Stephens and Robert L. Whetten},
        Date-Added = {2007-09-06 13:34:10 -0400},
        Date-Modified = {2007-09-06 13:34:10 -0400},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Cleveland/1997a.pdf},
        Pages = {1873-1876},
        Title = {Structural Evolution of Smaller Gold Nanocrystals: The Truncated Decahedral Motif},
        Volume = {79},
        Year = {1997},
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@article{Roy:2003dy,
        Author = {R.K. Roy and S.K. Mandal and A.K. Pal},
        Date-Added = {2007-09-06 13:32:38 -0400},
        Date-Modified = {2007-09-06 13:32:38 -0400},
        Journal = {Eur. Phys. J. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Roy/2003.pdf},
        Pages = {109-114},
        Title = {Effect of interfacial alloying on the surface plasmon resonance of nanocrystalline Au-Ag multilayer thin films},
        Volume = {33},
        Year = {2003},
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@article{gonzalo:5163,
        Author = {J. Gonzalo and D. Babonneau and C. N. Afonso and J.-P. Barnes},
        Date-Added = {2007-09-06 13:32:05 -0400},
        Date-Modified = {2009-01-25 21:41:45 -0500},
        Journal = {J. Appl. Phys.},
        Keywords = {alumina; silver; copper; nanocomposites; metallic thin films; pulsed laser deposition; surface plasmon resonance; spectral line shift; nucleation; visible spectra; electron diffraction; electron microscopy},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Gonzalo/2004.pdf},
        Number = {9},
        Pages = {5163-5168},
        Publisher = {AIP},
        Title = {Optical response of mixed Ag-Cu nanocrystals produced by pulsed laser deposition},
        Url = {http://link.aip.org/link/?JAP/96/5163/1},
        Volume = {96},
        Year = {2004},
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@article{Kim:2003lv,
        Author = {M. Kim and H. Na and K. C. Lee and E. A. Yoo and M. Lee},
        Date-Added = {2007-09-06 13:31:15 -0400},
        Date-Modified = {2007-09-06 13:31:15 -0400},
        Journal = {J. Mat. Chem},
        Number = {7},
        Pages = {1789-1792},
        Title = {Preperation and characterization of Au-Ag and Au-Cu alloy nanoparticles in chloroform.},
        Volume = {13},
        Year = {2003}}

@article{Malyavantham:2004cu,
        Author = {Malyavantham, Gokul and O'Brien, Daniel T. and Becker, Michael F. and Keto, John W. and Kovar, Desiderio},
        Date-Added = {2007-09-06 13:30:22 -0400},
        Date-Modified = {2009-01-25 21:57:38 -0500},
        Journal = {J. Nanopart. Res.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Malyavantham/2004.pdf},
        Number = {6},
        Pages = {661 --664},
        Title = {Au-Cu nanoparticles produced by laser ablation of mixtures of Au and Cu microparticles},
        Ty = {JOUR},
        Url = {http://www.springerlink.com/openurl.asp?genre=article\& id=doi:10.1007/s11051-004-3212-z},
        Volume = {6},
        Year = {2004},
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@article{Ludwig:2003lr,
        Address = {Physikalische Chemie, Fachbereich Chemie, Universitat Dortmund, Otto-Hahn-Strasse 6, 44221 Dortmund, Germany. ludwig@pc2a.chemie.uni-dortmund.de},
        Au = {Ludwig, R},
        Author = {Ludwig, Ralf},
        Da = {20030805},
        Date-Added = {2007-07-16 17:00:26 -0400},
        Date-Modified = {2007-07-16 17:00:26 -0400},
        Dcom = {20040511},
        Doi = {10.1002/anie.200301658},
        Edat = {2003/08/06 05:00},
        Issn = {1433-7851 (Print)},
        Jid = {0370543},
        Journal = {Angew Chem Int Ed Engl},
        Jt = {Angewandte Chemie (International ed. in English)},
        Language = {eng},
        Lr = {20070119},
        Mhda = {2003/08/06 05:01},
        Number = {30},
        Own = {NLM},
        Pages = {3458--3460},
        Pl = {Germany},
        Pmid = {12900957},
        Pst = {ppublish},
        Pt = {Journal Article},
        Pubm = {Print},
        So = {Angew Chem Int Ed Engl. 2003 Aug 4;42(30):3458-60.},
        Stat = {PubMed-not-MEDLINE},
        Title = {How does water bind to metal surfaces: hydrogen atoms up or hydrogen atoms down?},
        Volume = {42},
        Year = {2003},
        Bdsk-Url-1 = {http://dx.doi.org/10.1002/anie.200301658}}

@article{SpohrE._j100353a043,
        Author = {Spohr, E.},
        Date-Added = {2007-07-16 16:44:34 -0400},
        Date-Modified = {2009-01-25 21:52:04 -0500},
        Issn = {0022-3654},
        Journal = {J. Phys. Chem.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Spohr/1989.pdf},
        Number = {16},
        Pages = {6171-6180},
        Title = {Computer simulation of the water/platinum interface},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/j100353a043},
        Volume = {93},
        Year = {1989},
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@article{kay:5120,
        Author = {Bruce D. Kay and Keith R. Lykke and J. Randall Creighton and Stephen J. Ward},
        Date-Added = {2007-07-16 14:10:25 -0400},
        Date-Modified = {2007-07-16 14:10:38 -0400},
        Doi = {10.1063/1.457606},
        Journal = {The Journal of Chemical Physics},
        Keywords = {CHEMISORPTION; CHEMICAL BONDS; AMMONIA; HYDROFLUORIC ACID; WATER; GOLD; SORPTIVE PROPERTIES; LOW TEMPERATURE; DESORPTION; ADSORBATES; HYDROGEN BONDS; DESORPTION SPECTROSCOPY},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Kay/1989.pdf},
        Number = {8},
        Pages = {5120-5121},
        Publisher = {AIP},
        Title = {The influence of adsorbate--absorbate hydrogen bonding in molecular chemisorption: NH[sub 3], HF, and H[sub 2]O on Au(111)},
        Url = {http://link.aip.org/link/?JCP/91/5120/1},
        Volume = {91},
        Year = {1989},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/91/5120/1},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.457606}}

@article{MahaffyR._jp962281w,
        Affiliation = {Department of Chemistry, The Pennsylvania State University, University Park, Pennsylvania 16802},
        Author = {Mahaffy, R. and Bhatia, R. and Garrison, B.J.},
        Date-Added = {2007-07-05 12:36:54 -0400},
        Date-Modified = {2007-07-05 12:37:01 -0400},
        Issn = {1520-6106},
        Journal = {Journal of Physical Chemistry B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Mahaffy/1997.pdf},
        Number = {5},
        Pages = {771-773},
        Title = {Diffusion of a Butanethiolate Molecule on a Au{111} Surface},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp962281w},
        Volume = {101},
        Year = {1997},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp962281w}}

@article{LuedtkeW.D._jp981745i,
        Affiliation = {School of Physics, Georgia Institute of Technology, Atlanta, Georgia 30332-0430},
        Author = {Luedtke, W.D. and Landman, U.},
        Date-Added = {2007-07-05 12:13:33 -0400},
        Date-Modified = {2007-07-05 12:13:42 -0400},
        Issn = {1520-6106},
        Journal = {Journal of Physical Chemistry B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Luedtke/1998.pdf},
        Number = {34},
        Pages = {6566-6572},
        Title = {Structure and Thermodynamics of Self-Assembled Monolayers on Gold Nanocrystallites},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp981745i},
        Volume = {102},
        Year = {1998},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp981745i}}

@article{LuedtkeW.D._jp961721g,
        Affiliation = {School of Physics, Georgia Institute of Technology, Atlanta, Georgia 30332},
        Author = {Luedtke, W.D. and Landman, U.},
        Date-Added = {2007-07-05 12:06:28 -0400},
        Date-Modified = {2007-07-05 12:07:32 -0400},
        Issn = {0022-3654},
        Journal = {Journal of Physical Chemistry},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Luedtke/1996.pdf},
        Number = {32},
        Pages = {13323-13329},
        Title = {Structure, Dynamics, and Thermodynamics of Passivated Gold Nanocrystallites and Their Assemblies},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp961721g},
        Volume = {100},
        Year = {1996},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp961721g}}

@article{0957-4484-17-18-037,
        Abstract = {Molecular dynamics simulations are used to investigate the microstructures of Cu\&ndash;Ni nanoparticles with different concentrations of oversized atoms added to them. A many body second moment tight binding approximation potential is adopted to model the interatomic interactions. The Honeycutt\&ndash;Anderson (HA) pair analysis technique is adopted to analyse in detail the transformation between local structures at different temperatures. From the simulation results, at temperatures higher than the melting point, the nanoparticles are in a liquid state and an icosahedral local structure is most frequently found inside the nanoparticles. At temperatures beneath the melting point, the fraction of FCC local structure increases with decreasing concentrations of the larger size atoms, whereas a larger fraction of amorphous structure still remains in the solid state for higher concentrations of oversized atoms. This is because the effects of distortion and misfit are more significant for a nanoparticle having a higher concentration of oversized atoms. },
        Author = {Shin-Pon Ju and Cheng-I Weng and Yi-Yun Chang and Yung-Yun Chen},
        Date-Added = {2007-07-02 01:26:44 -0400},
        Date-Modified = {2007-07-02 01:26:56 -0400},
        Journal = {Nanotechnology},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Ju/2006.pdf},
        Number = {18},
        Pages = {4748-4757},
        Title = {The effect of added oversized elements on the microstructure of binary alloy nanoparticles},
        Url = {http://stacks.iop.org/0957-4484/17/4748},
        Volume = {17},
        Year = {2006},
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        Bdsk-Url-1 = {http://stacks.iop.org/0957-4484/17/4748}}

@article{Miracle:2006qy,
        Author = {Miracle, D. B.},
        Date-Added = {2007-07-01 16:38:41 -0400},
        Date-Modified = {2007-07-01 16:38:59 -0400},
        Journal = {Acta Materialia},
        Keywords = {Metallic glasses; Atomic structure; Modeling},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Miracle/2006.pdf},
        Number = {16},
        Pages = {4317--4336},
        Title = {The efficient cluster packing model - An atomic structural model for metallic glasses},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TW8-4KKFPJ4-1/2/3bbef4be6c2fefecca2370b67cc5f7e2},
        Volume = {54},
        Year = {2006},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TW8-4KKFPJ4-1/2/3bbef4be6c2fefecca2370b67cc5f7e2}}

@article{Manai:2007fk,
        Author = {Manai, G. and Delogu, F.},
        Date-Added = {2007-07-01 16:29:22 -0400},
        Date-Modified = {2007-07-01 16:29:49 -0400},
        Journal = {Physica B: Condensed Matter},
        Keywords = {Molecular dynamics; Melting; Bulk metal; Nanocrystalline metal; Kinetics},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Manai/2007.pdf},
        Number = {1-2},
        Pages = {288--297},
        Title = {Numerical simulations of the melting behavior of bulk and nanometer-sized Cu systems},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TVH-4MMFJ3P-1/2/23cfabe81d2b2b75cf1322fff7438ea0},
        Volume = {392},
        Year = {2007},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TVH-4MMFJ3P-1/2/23cfabe81d2b2b75cf1322fff7438ea0}}

@article{Iwamatsu:2007lr,
        Author = {Iwamatsu, Masao},
        Date-Added = {2007-07-01 16:17:54 -0400},
        Date-Modified = {2009-01-25 21:45:30 -0500},
        Journal = {Mat. Sci. Eng. A},
        Keywords = {Binary cluster; Icosahedral cluster; Binary alloy; Glass; Undercooled liquid},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Iwamatsu/2007.pdf},
        Pages = {975--978},
        Title = {Icosahedral binary clusters of glass-forming Lennard-Jones binary alloy},
        Title1 = {Proceedings of the 12th International Conference on Rapidly Quenched \& Metastable Materials},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TXD-4KPP4D7-12/2/068458774eaf66383a5a3eefe2118657},
        Volume = {449-451},
        Year = {2007},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TXD-4KPP4D7-12/2/068458774eaf66383a5a3eefe2118657}}

@article{HoneycuttJ.Dana_j100303a014,
        Author = {Honeycutt, J. Dana and Andersen, Hans C.},
        Date-Added = {2007-07-01 13:21:04 -0400},
        Date-Modified = {2009-01-25 21:45:10 -0500},
        Issn = {0022-3654},
        Journal = {J. Phys. Chem.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Honeycutt/1987.pdf},
        Number = {19},
        Pages = {4950-4963},
        Title = {Molecular dynamics study of melting and freezing of small Lennard-Jones clusters},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/j100303a014},
        Volume = {91},
        Year = {1987},
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQGQAAAAAAGQAAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFLVYIMTk4Ny5wZGYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUtV8KtWe4AAAAAAAAAAAABAAMAAAkgAAAAAAAAAAAAAAAAAAAACUhvbmV5Y3V0dAAAEAAIAADEHbuOAAAAEQAIAADCrZIuAAAAAQAUAAUtVgAFCOEAAw/3AAMP4AAAeY4AAgA+TWFjaW50b3NoIEhEOlVzZXJzOmNoYXJsZXM6RG9jdW1lbnRzOlBhcGVyczpIb25leWN1dHQ6MTk4Ny5wZGYADgASAAgAMQA5ADgANwAuAHAAZABmAA8AGgAMAE0AYQBjAGkAbgB0AG8AcwBoACAASABEABIAMVVzZXJzL2NoYXJsZXMvRG9jdW1lbnRzL1BhcGVycy9Ib25leWN1dHQvMTk4Ny5wZGYAABMAAS8AABUAAgAO//8AANIeHyAhWCRjbGFzc2VzWiRjbGFzc25hbWWjISIjXU5TTXV0YWJsZURhdGFWTlNEYXRhWE5TT2JqZWN0XxAcLi4vUGFwZXJzL0hvbmV5Y3V0dC8xOTg3LnBkZtIeHyYnoicjXE5TRGljdGlvbmFyeQAIABEAGgAfACkAMgA3ADoAPwBBAFMAXABiAGkAcAB4AIMAhQCIAIoAjACPAJEAkwCdAKoArwC3ALkCTQJSAlsCZgJqAngCfwKIAqcCrAKvAAAAAAAAAgEAAAAAAAAAKAAAAAAAAAAAAAAAAAAAArw=},
        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/j100303a014}}

@article{PhysRevLett.60.2295,
        Author = {J\'onsson, Hannes and Andersen, Hans C.},
        Date-Added = {2007-07-01 13:05:37 -0400},
        Date-Modified = {2007-07-01 13:06:07 -0400},
        Doi = {10.1103/PhysRevLett.60.2295},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/J%5C'onsson/1988.pdf},
        Month = {May},
        Number = {22},
        Numpages = {3},
        Pages = {2295--2298},
        Publisher = {American Physical Society},
        Title = {Icosahedral Ordering in the Lennard-Jones Liquid and Glass},
        Volume = {60},
        Year = {1988},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.60.2295}}

@article{Buscaglia:1997fk,
        Author = {Gustavo C. Buscaglia and Enzo A. Dari},
        Date-Added = {2007-06-15 13:34:55 -0400},
        Date-Modified = {2007-06-15 13:37:30 -0400},
        Journal = {International Journal for Numerical Methods in Engineering},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Buscaglia/1997.pdf},
        Number = {22},
        Pages = {4119-4136},
        Title = {Anisotropic mesh optimization and its application in adaptivity},
        Volume = {40},
        Year = {1997},
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQGQAAAAAAGQAAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFLRcIMTk5Ny5wZGYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUtGMKYRmwAAAAAAAAAAAABAAMAAAkgAAAAAAAAAAAAAAAAAAAACUJ1c2NhZ2xpYQAAEAAIAADEHbuOAAAAEQAIAADCmH6sAAAAAQAUAAUtFwAFCOEAAw/3AAMP4AAAeY4AAgA+TWFjaW50b3NoIEhEOlVzZXJzOmNoYXJsZXM6RG9jdW1lbnRzOlBhcGVyczpCdXNjYWdsaWE6MTk5Ny5wZGYADgASAAgAMQA5ADkANwAuAHAAZABmAA8AGgAMAE0AYQBjAGkAbgB0AG8AcwBoACAASABEABIAMVVzZXJzL2NoYXJsZXMvRG9jdW1lbnRzL1BhcGVycy9CdXNjYWdsaWEvMTk5Ny5wZGYAABMAAS8AABUAAgAO//8AANIeHyAhWCRjbGFzc2VzWiRjbGFzc25hbWWjISIjXU5TTXV0YWJsZURhdGFWTlNEYXRhWE5TT2JqZWN0XxAcLi4vUGFwZXJzL0J1c2NhZ2xpYS8xOTk3LnBkZtIeHyYnoicjXE5TRGljdGlvbmFyeQAIABEAGgAfACkAMgA3ADoAPwBBAFMAXABiAGkAcAB4AIMAhQCIAIoAjACPAJEAkwCdAKoArwC3ALkCTQJSAlsCZgJqAngCfwKIAqcCrAKvAAAAAAAAAgEAAAAAAAAAKAAAAAAAAAAAAAAAAAAAArw=}}

@article{Guymon:2005fk,
        Author = {C.G. Guymon and R.L. Rowley and J. N. Harb and D.R. Wheeler},
        Date-Added = {2007-06-07 14:31:36 -0400},
        Date-Modified = {2007-06-07 14:34:21 -0400},
        Journal = {Condensed Matter Physics},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Guymon/2005.pdf},
        Number = {2},
        Pages = {335-356},
        Title = {Simulating an electrochemical interface using charge dynamics},
        Volume = {8},
        Year = {2005},
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@article{MURRAY:1984lr,
        Author = {Murray, J. L.},
        Date-Added = {2007-05-16 15:08:28 -0400},
        Date-Modified = {2007-05-16 15:17:54 -0400},
        Isi = {ISI:A1984SC15900002},
        Issn = {0360-2133},
        Journal = {Metall Trans},
        Number = {2},
        Pages = {261-268},
        Publication-Type = {J},
        Title = {CALCULATIONS OF STABLE AND METASTABLE EQUILIBRIUM DIAGRAMS OF THE AG-CU AND CD-ZN SYSTEMS},
        Volume = {15},
        Year = {1984}}

@misc{kimura-quantum,
        Author = {Y. Kimura and T. Cagin},
        Date-Added = {2007-05-15 16:46:32 -0400},
        Date-Modified = {2007-05-15 17:56:21 -0400},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Goddard%20III/51.pdf},
        Text = {Y. Kimura, T. Cagin, and W. A. Goddard III, The Quantum Sutton-Chen ManyBody Potential for Properties of FCC metals, Phys. Rev., to be submitted.},
        Title = {The Quantum Sutton-Chen ManyBody Potential for Properties of FCC metals},
        Url = {citeseer.ist.psu.edu/150963.html},
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        Bdsk-Url-1 = {citeseer.ist.psu.edu/150963.html}}

@article{neubauer:046106,
        Author = {H. Neubauer and S. G. Mayr},
        Date-Added = {2007-05-10 17:42:37 -0400},
        Date-Modified = {2007-05-10 17:49:52 -0400},
        Eid = {046106},
        Journal = {Journal of Applied Physics},
        Keywords = {copper alloys; gold alloys; nanostructured materials; metal clusters; liquid alloys; molecular dynamics method; surface energy; fluctuations; rotation},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Neubauer/2007.pdf},
        Number = {4},
        Numpages = {3},
        Pages = {046106},
        Publisher = {AIP},
        Title = {Dealloying of liquid CuAu nanoclusters during rotary motion: A molecular dynamics study},
        Url = {http://link.aip.org/link/?JAP/101/046106/1},
        Volume = {101},
        Year = {2007},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JAP/101/046106/1}}

@article{0965-0393-7-2-005,
        Abstract = {The multilayer relaxation at (100), (110), (111), (210), (211), (310), (311) and (331) surfaces of the fcc metals Cu, Ag, Au, Ni, Pd, Pt, Al and Pb are calculated using the modified embedded atom method. The `anomalous' outward relaxation at Al (100), (111), Pt (111), and Cu (111) surfaces is described correctly. The relief of surface stress and tension on the relaxation is studied on (111), (100) and (110) surfaces. In general, the surface stress in the direction of the surface normal determines the relaxation direction except for the Al (110) surface. When the surface stress is negative, the surface relaxation is inward; otherwise, the relaxation is outward. An interesting result is that the surface tension does not always decrease after relaxation. The outward relaxation will induce the increase in surface tension while the inward relaxation induces the decrease in surface tension. },
        Author = {Jun Wan and Y L Fan and D W Gong and S G Shen and X Q Fan},
        Date-Added = {2007-05-08 16:04:42 -0400},
        Date-Modified = {2007-05-08 16:04:50 -0400},
        Journal = {Modelling and Simulation in Materials Science and Engineering},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Wan/1999.pdf},
        Number = {2},
        Pages = {189-206},
        Title = {Surface relaxation and stress of fcc metals: Cu, Ag, Au, Ni, Pd, Pt, Al and Pb},
        Url = {http://stacks.iop.org/0965-0393/7/189},
        Volume = {7},
        Year = {1999},
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        Bdsk-Url-1 = {http://stacks.iop.org/0965-0393/7/189}}

@article{Chen:2001qy,
        Author = {Chen, M. and Yang, C. and Guo, Z. Y.},
        Date-Added = {2007-05-08 15:48:11 -0400},
        Date-Modified = {2007-05-08 15:48:22 -0400},
        Journal = {International Journal of Thermophysics},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/fulltext.pdf},
        M3 = {10.1023/A:1010632813438},
        Number = {4},
        Pages = {1295--1302},
        Title = {Surface Tension of Ni-Cu Alloys: A Molecular Simulation Approach},
        Ty = {JOUR},
        Url = {http://dx.doi.org/10.1023/A:1010632813438},
        Volume = {22},
        Year = {2001},
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQGEAAAAAAGEAAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFCOEMZnVsbHRleHQucGRmAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUtOcJmTCYAAAAAAAAAAAABAAIAAAkgAAAAAAAAAAAAAAAAAAAABlBhcGVycwAQAAgAAMQdu44AAAARAAgAAMJmhGYAAAABABAABQjhAAMP9wADD+AAAHmOAAIAOE1hY2ludG9zaCBIRDpVc2VyczpjaGFybGVzOkRvY3VtZW50czpQYXBlcnM6ZnVsbHRleHQucGRmAA4AGgAMAGYAdQBsAGwAdABlAHgAdAAuAHAAZABmAA8AGgAMAE0AYQBjAGkAbgB0AG8AcwBoACAASABEABIAK1VzZXJzL2NoYXJsZXMvRG9jdW1lbnRzL1BhcGVycy9mdWxsdGV4dC5wZGYAABMAAS8AABUAAgAO//8AANIeHyAhWCRjbGFzc2VzWiRjbGFzc25hbWWjISIjXU5TTXV0YWJsZURhdGFWTlNEYXRhWE5TT2JqZWN0XxAWLi4vUGFwZXJzL2Z1bGx0ZXh0LnBkZtIeHyYnoicjXE5TRGljdGlvbmFyeQAIABEAGgAfACkAMgA3ADoAPwBBAFMAXABiAGkAcAB4AIMAhQCIAIoAjACPAJEAkwCdAKoArwC3ALkCQQJGAk8CWgJeAmwCcwJ8ApUCmgKdAAAAAAAAAgEAAAAAAAAAKAAAAAAAAAAAAAAAAAAAAqo=},
        Bdsk-Url-1 = {http://dx.doi.org/10.1023/A:1010632813438}}

@article{Bondi:1964fk,
        Author = {A. Bondi},
        Date-Added = {2007-05-08 14:44:17 -0400},
        Date-Modified = {2007-05-08 14:45:19 -0400},
        Journal = {J. Phys. Chem.},
        Number = {3},
        Pages = {441-451},
        Title = {van der Waals Volumes and Radii},
        Volume = {63},
        Year = {1964}}

@article{0957-0233-16-2-015,
        Abstract = {It is usually known that the surface tension of liquid metals and alloys decreases with increasing temperature, i.e., the temperature dependence of the surface tension is negative. We found, however, that some liquid alloys, which have large difference of the surface tension of pure components, show positive temperature dependence in certain composition ranges. Some Pb-free alloys, for which information on the surface tension is indispensable to be developed as environmental-friendly material, can be listed in this special category. The experimental results and the thermodynamic analysis of the temperature dependence of those alloys are discussed in the paper. },
        Author = {Joonho Lee and Wataru Shimoda and Toshihiro Tanaka},
        Date-Added = {2007-05-08 13:32:00 -0400},
        Date-Modified = {2007-05-08 13:32:14 -0400},
        Journal = {Measurement Science and Technology},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/mst5_2_015.pdf},
        Number = {2},
        Pages = {438-442},
        Title = {Temperature dependence of surface tension of liquid Sn\&ndash;Ag, In\&ndash;Ag and In\&ndash;Cu alloys},
        Url = {http://stacks.iop.org/0957-0233/16/438},
        Volume = {16},
        Year = {2005},
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        Bdsk-Url-1 = {http://stacks.iop.org/0957-0233/16/438}}

@article{PhysRevLett.75.4043,
        Author = {Egry, Ivan and Lohoefer, Georg and Jacobs, Gerd},
        Date-Added = {2007-05-08 13:24:35 -0400},
        Date-Modified = {2007-05-08 13:24:35 -0400},
        Doi = {10.1103/PhysRevLett.75.4043},
        Journal = {Phys. Rev. Lett.},
        Month = {Nov},
        Number = {22},
        Numpages = {3},
        Pages = {4043--4046},
        Publisher = {American Physical Society},
        Title = {Surface Tension of Liquid Metals: Results from Measurements on Ground and in Space},
        Volume = {75},
        Year = {1995},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.75.4043}}

@article{mendez-villuendas:185503,
        Author = {Eduardo Mendez-Villuendas and Richard K. Bowles},
        Date-Added = {2007-05-08 13:19:27 -0400},
        Date-Modified = {2007-05-08 13:19:42 -0400},
        Eid = {185503},
        Journal = {Physical Review Letters},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/PhysRevLett_98_185503.pdf},
        Number = {18},
        Numpages = {4},
        Pages = {185503},
        Publisher = {APS},
        Title = {Surface Nucleation in the Freezing of Gold Nanoparticles},
        Url = {http://link.aps.org/abstract/PRL/v98/e185503},
        Volume = {98},
        Year = {2007},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aps.org/abstract/PRL/v98/e185503}}

@misc{garai-2006,
        Author = {Jozsef Garai},
        Date-Added = {2007-05-08 13:13:26 -0400},
        Date-Modified = {2007-05-08 13:13:38 -0400},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Surf_tension_vap.pdf},
        Title = {Atomic Model for the Latent Heat of Vaporization},
        Url = {http://www.citebase.org/abstract?id=oai:arXiv.org:physics/0611289},
        Year = {2006},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://www.citebase.org/abstract?id=oai:arXiv.org:physics/0611289}}

@article{garai:023514,
        Author = {J. Garai and A. Laugier},
        Date-Added = {2007-05-08 13:08:58 -0400},
        Date-Modified = {2007-05-08 13:09:20 -0400},
        Eid = {023514},
        Journal = {Journal of Applied Physics},
        Keywords = {elastic moduli; thermal expansion; silver; gold; magnesium compounds; alumina; iron compounds; calcium compounds; sodium compounds; potassium compounds; high-pressure effects},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JApplPhys_101_023514.pdf},
        Number = {2},
        Numpages = {4},
        Pages = {023514},
        Publisher = {AIP},
        Title = {The temperature dependence of the isothermal bulk modulus at 1 bar pressure},
        Url = {http://link.aip.org/link/?JAP/101/023514/1},
        Volume = {101},
        Year = {2007},
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@article{PhysRevB.59.15990,
        Author = {Ruban, A. V. and Skriver, H. L. and N\o{}rskov, J. K.},
        Date-Added = {2007-05-07 11:33:33 -0400},
        Date-Modified = {2007-05-07 11:34:34 -0400},
        Doi = {10.1103/PhysRevB.59.15990},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/p15990_1.pdf},
        Month = {Jun},
        Number = {24},
        Numpages = {10},
        Pages = {15990--16000},
        Publisher = {American Physical Society},
        Title = {Surface segregation energies in transition-metal alloys},
        Volume = {59},
        Year = {1999},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.59.15990}}

@article{Ramirez-Caballero:2006lr,
        Abstract = {Classical molecular dynamics (MD) simulations are used to investigate the effect of the nanocluster size on surface segregation phenomena of Pt alloys containing 10, 30, 50, 70 and 90{\%} Pd. Atomic distribution is examined in graphite-supported nanoclusters with approximate diameters of 2 and 4 nm, using a simulated annealing procedure with temperatures varying from 1200 down to 353 K. Following this annealing route, it is found that at concentrations of Pd below a certain threshold, Pt segregates to the surface, whereas Pd segregates to the surface when the overall concentration of Pd is above that threshold. Moreover, the threshold concentration depends on the size, being approximately 50{\%} for the 2 nm nanocluster and in the order of 60{\%} for the 4 nm nanocluster. It is also found that the percent of the surface enriched either in Pt or Pd at a given overall concentration, as well as the nature of the exposed crystallographic faces, depend significantly on the cluster size. Our studies suggest that surface segregation behavior in Pt{\^a}Pd supported nanoclusters is influenced by: differences in surface energies, interaction of the clusters with the substrate, and probably most importantly by the fabrication protocol. The implications of these issues on catalytic processes are discussed. ABSTRACT FROM AUTHOR Copyright of Molecular Simulation is the property of Taylor \& Francis Ltd and its content may not be copied or emailed to multiple sites or posted to a listserv without the copyright holder's express written permission. However, users may print, download, or email articles for individual use. This abstract may be abridged. No warranty is given about the accuracy of the copy. Users should refer to the original published version of the material for the full abstract. (Copyright applies to all Abstracts)},
        Author = {Ramirez Caballero, G. E. and Balbuena, P. B.},
        Date-Added = {2007-05-04 12:08:33 -0400},
        Date-Modified = {2009-01-25 21:48:26 -0500},
        Isbn = {08927022},
        Journal = {Mol. Sim.},
        Keywords = {ALLOYS; METALLIC composites; MOLECULAR dynamics; NANOPARTICLES; SURFACE chemistry; Molecular dynamics; Bimetallic particles},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Ramirez%20Caballero/2006.pdf},
        M3 = {Article},
        Number = {3/4},
        Pages = {297-303},
        Publisher = {Taylor \& Francis Ltd},
        Title = {Surface segregation phenomena in {P}t{P}d nanoparticles: dependence on nanocluster size.},
        Url = {http://search.ebscohost.com/login.aspx?direct=true&db=aph&AN=21894920&site=ehost-live},
        Volume = {32},
        Year = {2006},
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        Bdsk-Url-1 = {http://search.ebscohost.com/login.aspx?direct=true&db=aph&AN=21894920&site=ehost-live}}

@article{sankaranarayanan:155441,
        Author = {Subramanian K. R. S. Sankaranarayanan and Venkat R. Bhethanabotla and Babu Joseph},
        Date-Added = {2007-05-04 12:01:22 -0400},
        Date-Modified = {2007-05-04 12:01:28 -0400},
        Eid = {155441},
        Journal = {Physical Review B (Condensed Matter and Materials Physics)},
        Keywords = {molecular dynamics method; melting; platinum alloys; palladium alloys; nanowires; surface segregation; specific heat; diffusion; surface structure; solid-state phase transformations; thermal stability; annealing},
        Local-Url = {file://localhost/Users/charles/Desktop/Papers/PhysRevB_74_155441.pdf},
        Number = {15},
        Numpages = {12},
        Pages = {155441},
        Publisher = {APS},
        Title = {Molecular dynamics simulation study of the melting and structural evolution of bimetallic Pd-Pt nanowires},
        Url = {http://link.aps.org/abstract/PRB/v74/e155441},
        Volume = {74},
        Year = {2006},
        Bdsk-Url-1 = {http://link.aps.org/abstract/PRB/v74/e155441}}

@article{RuuskaH._jp031022l,
        Affiliation = {Department of Chemical Engineering, Brigham Young University, Provo, Utah 84602},
        Author = {Ruuska, H. and Pakkanen, T.A. and Rowley, R.L.},
        Date-Added = {2007-05-01 18:24:50 -0400},
        Date-Modified = {2007-05-01 18:25:03 -0400},
        Issn = {1520-6106},
        Journal = {Journal of Physical Chemistry B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp031022l.pdf},
        Number = {8},
        Pages = {2614-2619},
        Title = {MP2 Study on Water Adsorption on Cluster Models of Cu(111)},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp031022l},
        Volume = {108},
        Year = {2004},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp031022l}}

@book{Goldberg1989,
        Address = {Boston, MA, USA},
        Author = {David E. Goldberg},
        Date-Added = {2007-04-26 16:43:54 -0400},
        Date-Modified = {2007-04-26 16:44:19 -0400},
        Isbn = {0201157675},
        Publisher = {Addison-Wesley Longman Publishing Co., Inc.},
        Title = {Genetic Algorithms in Search, Optimization and Machine Learning},
        Year = {1989}}

@article{fennell:9175,
        Author = {Christopher J. Fennell and J. Daniel Gezelter},
        Date-Added = {2007-04-26 16:40:20 -0400},
        Date-Modified = {2007-04-26 16:40:53 -0400},
        Journal = {The Journal of Chemical Physics},
        Keywords = {molecular dynamics method; self-diffusion; ice; water; supercooling; liquid structure; liquid theory},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_120_9175.pdf},
        Number = {19},
        Pages = {9175-9184},
        Publisher = {AIP},
        Title = {On the structural and transport properties of the soft sticky dipole and related single-point water models},
        Url = {http://link.aip.org/link/?JCP/120/9175/1},
        Volume = {120},
        Year = {2004},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/120/9175/1}}

@article{LiuY._jp952324t,
        Affiliation = {Departments of Biochemistry and Biophysics and of Chemistry, Washington State University, Pullman, Washington 99164-4660},
        Author = {Liu, Y. and Ichiye, T.},
        Date-Added = {2007-04-26 16:38:23 -0400},
        Date-Modified = {2009-01-25 21:53:47 -0500},
        Issn = {0022-3654},
        Journal = {J. Phys. Chem.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp952324t.pdf},
        Number = {7},
        Pages = {2723-2730},
        Title = {Soft Sticky Dipole Potential for Liquid Water: A New Model},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp952324t},
        Volume = {100},
        Year = {1996},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp952324t}}

@article{PhysRevB.33.7983,
        Author = {Foiles, S. M. and Baskes, M. I. and Daw, M. S.},
        Date-Added = {2007-04-24 19:12:57 -0400},
        Date-Modified = {2007-04-24 19:14:30 -0400},
        Doi = {10.1103/PhysRevB.33.7983},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/p7983_1.pdf},
        Month = {Jun},
        Number = {12},
        Numpages = {8},
        Pages = {7983--7991},
        Publisher = {American Physical Society},
        Title = {Embedded-atom-method functions for the fcc metals {C}u, {A}g, {A}u, {N}i, {P}d, {P}t, and their alloys},
        Volume = {33},
        Year = {1986},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.33.7983}}

@url{Center:uq,
        Author = {http://www.qhull.org},
        Date-Added = {2007-04-24 18:04:23 -0400},
        Date-Modified = {2007-04-24 18:06:31 -0400},
        Title = {QHull},
        Url = {http://www.qhull.org},
        Urldate = {2007},
        Bdsk-Url-1 = {http://www.qhull.org}}

@article{barber96quickhull,
        Author = {C. Bradford Barber and David P. Dobkin and Hannu Huhdanpaa},
        Date-Added = {2007-04-24 18:03:53 -0400},
        Date-Modified = {2007-04-24 18:03:53 -0400},
        Journal = {ACM Transactions on Mathematical Software},
        Number = {4},
        Pages = {469--483},
        Title = {The Quickhull Algorithm for Convex Hulls},
        Url = {citeseer.ist.psu.edu/article/barber95quickhull.html},
        Volume = {22},
        Year = {1996},
        Bdsk-Url-1 = {citeseer.ist.psu.edu/article/barber95quickhull.html}}

@article{II:2007fk,
        Author = {Charles ~F. {Vardeman II} and J. Daniel Gezelter},
        Date-Added = {2007-04-24 17:54:43 -0400},
        Date-Modified = {2007-04-24 17:57:35 -0400},
        Journal = {In Preperation},
        Year = {2007}}

@article{HartlandG.V._jp0276092,
        Affiliation = {Department of Mathematics and Statistics, The University of Melbourne, Victoria 3010, Australia},
        Author = {Hartland, G.V. and Hu, M. and Sader, J.E.},
        Date-Added = {2007-04-24 17:45:57 -0400},
        Date-Modified = {2009-01-25 21:37:43 -0500},
        Issn = {1520-6106},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp0276092.pdf},
        Number = {30},
        Pages = {7472-7478},
        Title = {Softening of the Symmetric Breathing Mode in Gold Particles by Laser-Induced Heating},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp0276092},
        Volume = {107},
        Year = {2003},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp0276092}}

@book{Tu:1992uq,
        Author = {K. N. Tu and J. W. Mayer},
        Date-Added = {2007-04-24 17:27:23 -0400},
        Date-Modified = {2007-04-24 17:29:08 -0400},
        Publisher = {Macmillian: New York},
        Title = {Electronic Thin Film Science},
        Year = {1992}}

@article{Williams:1970fk,
        Author = {Graham Williams and David C. Watts},
        Date-Added = {2007-04-24 17:02:39 -0400},
        Date-Modified = {2007-04-24 17:50:10 -0400},
        Journal = {Trans. Faraday Soc.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/KWW%20paper.pdf},
        Pages = {80-85},
        Title = {Non-symmeric dielectric relaxation behaviour arising from a simple empirical decay function},
        Volume = {66},
        Year = {1970},
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@article{kumar:204508,
        Author = {V. Senthil Kumar and V. Kumaran},
        Date-Added = {2007-02-21 15:46:43 -0500},
        Date-Modified = {2007-02-21 15:47:50 -0500},
        Eid = {204508},
        Journal = {The Journal of Chemical Physics},
        Keywords = {freezing; nucleation; phase equilibrium; stacking faults},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Kumar/2006.pdf},
        Number = {20},
        Numpages = {11},
        Pages = {204508},
        Publisher = {AIP},
        Title = {Bond-orientational analysis of hard-disk and hard-sphere structures},
        Url = {http://link.aip.org/link/?JCP/124/204508/1},
        Volume = {124},
        Year = {2006},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/124/204508/1}}

@article{http://dx.doi.org/10.1039/b312640b,
        Abstract = {We explore, with the use of extensive molecular dynamics simulations, several principal issues pertaining to the energetics of formation of superlattices made through the assembly of passivated nanoclusters, the interactions that underlie the cohesion of such superlattices, and the unique mechanical, thermal and structural properties that they exhibit. Our investigations focus on assemblies made of crystalline gold nanoclusters of variable sizes, passivated by monolayers of alkylthiol molecules. An analytic optimal packing model that correlates in a unified manner several structural characteristics of three-dimensional superlattice assemblies is developed. The model successfully organizes and systematizes a large amount of experimental and simulation data, and it predicts the phase-boundary between different superlattice structural motifs that evolve as a function of the ratio between the chain-length of the extended passivating molecules and the radius of the underlying gold nanocluster. The entropic contribution to the formation free energy of the superlattice assembly is found to be large and of similar magnitude as the potential energy component of the free energy. The major contribution to the cohesive potential energy of the superlattice is shown to originate from van der Waals interactions between molecules that passivate neighboring nanoclusters. The unique mechanical, thermal, thermomechanical, and thermostructural properties of passivated nanocluster assemblies, are discussed.},
        Author = {Uzi Landman and W. D. Luedtke},
        Date-Added = {2007-02-20 19:42:37 -0500},
        Date-Modified = {2007-02-20 19:43:02 -0500},
        Doi = {10.1039/b312640b},
        Journal = {Faraday Discussions},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Landman/2004.pdf},
        Pages = {1--22},
        Title = {Small is different: energetic, structural, thermal, and mechanical properties of passivated nanocluster assemblies},
        Url = {http://dx.doi.org/10.1039/b312640b},
        Volume = {125},
        Year = {2004},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1039/b312640b}}

@article{PhysRevLett.89.275502,
        Author = {Nam, H.-S. and Hwang, Nong M. and Yu, B. D. and Yoon, J.-K.},
        Date-Added = {2007-02-20 19:13:35 -0500},
        Date-Modified = {2007-02-20 19:13:56 -0500},
        Doi = {10.1103/PhysRevLett.89.275502},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Nam/2002.pdf},
        Month = {Dec},
        Number = {27},
        Numpages = {4},
        Pages = {275502},
        Publisher = {American Physical Society},
        Title = {Formation of an Icosahedral Structure during the Freezing of Gold Nanoclusters: Surface-Induced Mechanism},
        Volume = {89},
        Year = {2002},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.89.275502}}

@article{LarsonI._la970029p,
        Affiliation = {Advanced Mineral Products Special Research Centre, University of Melbourne, Parkville, Victoria 3052, Australia, and CSIRO Division of Chemicals and Polymers, Private Bag 10, Rosebank MDC, Clayton, Victoria 3169, Australia},
        Author = {Larson, I. and Chan, D.Y.C. and Drummond, C.J. and Grieser, F.},
        Date-Added = {2007-02-20 19:05:40 -0500},
        Date-Modified = {2007-02-20 19:05:47 -0500},
        Issn = {0743-7463},
        Journal = {Langmuir},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Larson/1997.pdf},
        Number = {9},
        Pages = {2429-2431},
        Title = {Use of Atomic Force Microscopy Force Measurements To Monitor Citrate Displacement by Amines on Gold in Aqueous Solution},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/la970029p},
        Volume = {13},
        Year = {1997},
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQGGAAAAAAGGAAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFLZIIMTk5Ny5wZGYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUtk8IA9vMAAAAAAAAAAAABAAMAAAkgAAAAAAAAAAAAAAAAAAAABkxhcnNvbgAQAAgAAMQdu44AAAARAAgAAMIBPUMAAAABABQABS2SAAUI4QADD/cAAw/gAAB5jgACADtNYWNpbnRvc2ggSEQ6VXNlcnM6Y2hhcmxlczpEb2N1bWVudHM6UGFwZXJzOkxhcnNvbjoxOTk3LnBkZgAADgASAAgAMQA5ADkANwAuAHAAZABmAA8AGgAMAE0AYQBjAGkAbgB0AG8AcwBoACAASABEABIALlVzZXJzL2NoYXJsZXMvRG9jdW1lbnRzL1BhcGVycy9MYXJzb24vMTk5Ny5wZGYAEwABLwAAFQACAA7//wAA0h4fICFYJGNsYXNzZXNaJGNsYXNzbmFtZaMhIiNdTlNNdXRhYmxlRGF0YVZOU0RhdGFYTlNPYmplY3RfEBkuLi9QYXBlcnMvTGFyc29uLzE5OTcucGRm0h4fJieiJyNcTlNEaWN0aW9uYXJ5AAgAEQAaAB8AKQAyADcAOgA/AEEAUwBcAGIAaQBwAHgAgwCFAIgAigCMAI8AkQCTAJ0AqgCvALcAuQJDAkgCUQJcAmACbgJ1An4CmgKfAqIAAAAAAAACAQAAAAAAAAAoAAAAAAAAAAAAAAAAAAACrw==},
        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/la970029p}}

@article{PillaiZ.S._jp037018r,
        Affiliation = {Notre Dame Radiation Laboratory, Notre Dame, Indiana 46556-0579},
        Author = {Pillai, Z.S. and Kamat, P.V.},
        Date-Added = {2007-02-20 18:59:05 -0500},
        Date-Modified = {2007-02-20 18:59:19 -0500},
        Issn = {1520-6106},
        Journal = {Journal of Physical Chemistry B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Pillai/2004.pdf},
        Number = {3},
        Pages = {945-951},
        Title = {What Factors Control the Size and Shape of Silver Nanoparticles in the Citrate Ion Reduction Method?},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp037018r},
        Volume = {108},
        Year = {2004},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp037018r}}

@article{HengleinA._la981278w,
        Affiliation = {Notre Dame Radiation Laboratory and Department of Chemistry and Biochemistry, University of Notre Dame, Notre Dame, Indiana 46556-0579},
        Author = {Henglein, A. and Meisel, D.},
        Date-Added = {2007-02-20 18:35:29 -0500},
        Date-Modified = {2007-02-20 18:35:49 -0500},
        Issn = {0743-7463},
        Journal = {Langmuir},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Henglein/1998.pdf},
        Number = {26},
        Pages = {7392-7396},
        Title = {Radiolytic Control of the Size of Colloidal Gold Nanoparticles},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/la981278w},
        Volume = {14},
        Year = {1998},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/la981278w}}

@article{PhysRevE.56.4135,
        Author = {Bertolini, Davide and Tani, Alessandro},
        Date-Added = {2007-02-16 15:30:56 -0500},
        Date-Modified = {2007-02-16 15:31:04 -0500},
        Doi = {10.1103/PhysRevE.56.4135},
        Journal = {Phys. Rev. E},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Bertolini/1997.pdf},
        Month = {Oct},
        Number = {4},
        Numpages = {16},
        Pages = {4135--4151},
        Publisher = {American Physical Society},
        Title = {Thermal conductivity of water: Molecular dynamics and generalized hydrodynamics results},
        Volume = {56},
        Year = {1997},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevE.56.4135}}

@article{Tokumasu:2004lr,
        Abstract = {The thermal conductivity of diatomic liquids was analyzed using a nonequilibrium molecular dynamics (NEMD) method. Five liquids, namely, O2, CO, CS2, Cl2 and Br2, were assumed. The two-center Lennard-Jones (2CLJ) model was used to express the intermolecular potential acting on liquid molecules. First, the equation of state of each liquid was obtained using MD simulation, and the critical temperature, density and pressure of each liquid were determined. Heat conduction of each liquid at various liquid states {$[$}metastable ({$[$}rho{$]$}=1.9{$[$}rho{$]$}cr), saturated ({$[$}rho{$]$}=2.1{$[$}rho{$]$}cr), and stable ({$[$}rho{$]$}=2.3{$[$}rho{$]$}cr){$]$} at T=0.7Tcr was simulated and the thermal conductivity was estimated. These values were compared with experimental results and it was confirmed that the simulated results were consistent with the experimental data within 10{\%}. Obtained thermal conductivities at saturated state were reduced by the critical temperature, density and mass of molecules and these values were compared with each other. It was found that the reduced thermal conductivity increased with the increase in the molecular elongation. Detailed analysis of the molecular contribution to the thermal conductivity revealed that the contribution of the heat flux caused by energy transport and by translational energy transfer to the thermal conductivity is independent of the molecular elongation while the contribution of the heat flux caused by rotational energy transfer to the thermal conductivity increases with the increase in the molecular elongation. Moreover, by comparing the reduced thermal conductivity at various states, it was found that the increase of thermal conductivity with the increase in the density, or pressure, was caused by the increase of the contribution of energy transfer due to molecular interaction.},
        Author = {Tokumasu, Takashi and Kamijo, Kenjiro},
        Date-Added = {2007-02-16 15:23:00 -0500},
        Date-Modified = {2007-02-16 15:24:21 -0500},
        Journal = {Superlattices and Microstructures},
        Keywords = {Thermal conductivity; Nonequilibrium molecular dynamics; Diatomic liquid; Molecular elongation; Critical point},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Tokumasu/2004.pdf},
        Number = {3-6},
        Pages = {217--225},
        Title = {Molecular dynamics study for the thermal conductivity of diatomic liquid; Eurotherm 75 'Microscale Heat Transfer 2'},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6WXB-4CDJD1N-4/2/069b3dce0464dd2de1e61d14079e19d4},
        Volume = {35},
        Year = {2004},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6WXB-4CDJD1N-4/2/069b3dce0464dd2de1e61d14079e19d4}}

@article{VardemanC.F._jp051575r,
        Affiliation = {Department of Chemistry and Biochemistry, University of Notre Dame, Notre Dame, Indiana 46556},
        Author = {Vardeman, C.F. and Conforti, P.F. and Sprague, M.M. and Gezelter, J.D.},
        Date-Added = {2007-02-14 17:29:20 -0500},
        Date-Modified = {2009-01-25 21:39:32 -0500},
        Issn = {1520-6106},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Vardeman/2005.pdf},
        Number = {35},
        Pages = {16695-16699},
        Title = {Breathing Mode Dynamics and Elastic Properties of Gold Nanoparticles},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp051575r},
        Volume = {109},
        Year = {2005},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp051575r}}

@article{PhysRevB.66.224301,
        Author = {Wilson, Orla M. and Hu, Xiaoyuan and Cahill, David G. and Braun, Paul V.},
        Date-Added = {2007-02-09 18:52:24 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Doi = {10.1103/PhysRevB.66.224301},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Wilson/2002.pdf},
        Month = {Dec},
        Number = {22},
        Numpages = {6},
        Pages = {224301},
        Publisher = {American Physical Society},
        Title = {Colloidal metal particles as probes of nanoscale thermal transport in fluids},
        Volume = {66},
        Year = {2002},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.66.224301}}

@article{PhysRevB.59.3527,
        Author = {Qi, Yue and \c{C}a\v{g}in, Tahir and Kimura, Yoshitaka and {Goddard III}, William A.},
        Date-Added = {2007-02-09 18:34:34 -0500},
        Date-Modified = {2009-01-25 20:55:44 -0500},
        Doi = {10.1103/PhysRevB.59.3527},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Qi/1999.pdf},
        Month = {Feb},
        Number = {5},
        Numpages = {6},
        Pages = {3527--3533},
        Publisher = {American Physical Society},
        Title = {Molecular-dynamics simulations of glass formation and crystallization in binary liquid metals:\quad{}{C}u-{A}g and {C}u-{N}i},
        Volume = {59},
        Year = {1999},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.59.3527}}

@article{bhowmick:164513,
        Author = {Somnath Bhowmick and Vijay B. Shenoy},
        Date-Added = {2007-02-09 18:16:54 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {164513},
        Journal = {The Journal of Chemical Physics},
        Keywords = {stress effects; thermal conductivity; molecular dynamics method},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Bhowmick/2006.pdf},
        Number = {16},
        Numpages = {6},
        Pages = {164513},
        Publisher = {AIP},
        Title = {Effect of strain on the thermal conductivity of solids},
        Url = {http://link.aip.org/link/?JCP/125/164513/1},
        Volume = {125},
        Year = {2006},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/125/164513/1}}

@article{che:6888,
        Author = {Jianwei Che and Tahir Cagin and Weiqiao Deng and William A. Goddard III},
        Date-Added = {2007-02-09 18:02:08 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {The Journal of Chemical Physics},
        Keywords = {diamond; thermal conductivity; digital simulation; vacancies (crystal); Green's function methods; isotope effects},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Che/2000.pdf},
        Number = {16},
        Pages = {6888-6900},
        Publisher = {AIP},
        Title = {Thermal conductivity of diamond and related materials from molecular dynamics simulations},
        Url = {http://link.aip.org/link/?JCP/113/6888/1},
        Volume = {113},
        Year = {2000},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/113/6888/1}}

@article{Kob:1999fk,
        Abstract = {After a brief introduction to the dynamics of supercooled liquids, we discuss some of the advantages and drawbacks of computer simulations of such systems. Subsequently we present the results of computer simulations in which the dynamics of a fragile glass former, a binary Lennard-Jones system, is compared to that of a strong glass former, SiO$_{2}$. This comparison gives evidence that the reason for the different temperature dependences of these two types of glass former lies in the transport mechanism for the particles in the vicinity of T$_{c}$, the critical temperature of mode-coupling theory. Whereas that for the fragile glass former is described very well by the ideal version of mode-coupling theory, that for the strong glass former is dominated by activated processes. In the last part of the article we review some simulations of glass formers in which the dynamics below the glass transition temperature was investigated. We show that such simulations might help to establish a connection between systems with self-generated disorder (e.g. structural glasses) and quenched disorder (e.g. spin glasses). },
        Author = {Walter Kob},
        Date-Added = {2007-02-07 14:13:30 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Journal of Physics: Condensed Matter},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Kob/1999.pdf},
        Number = {10},
        Pages = {R85-R115},
        Title = {Computer simulations of supercooled liquids and glasses},
        Url = {http://stacks.iop.org/0953-8984/11/R85},
        Volume = {11},
        Year = {1999},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://stacks.iop.org/0953-8984/11/R85}}

@article{PhysRevB.61.5771,
        Author = {Soler, Jos\'e M. and Beltr\'an, Marcela R. and Michaelian, Karo and Garz\'on, Ignacio L. and Ordej\'on, Pablo and S\'anchez-Portal, Daniel and Artacho, Emilio},
        Date-Added = {2007-02-05 16:34:03 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Doi = {10.1103/PhysRevB.61.5771},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Soler/2000.pdf},
        Month = {Feb},
        Number = {8},
        Numpages = {9},
        Pages = {5771--5780},
        Publisher = {American Physical Society},
        Title = {Metallic bonding and cluster structure},
        Volume = {61},
        Year = {2000},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.61.5771}}

@article{0953-8984-14-26-101,
        Abstract = {We present a new method for constant-pressure molecular dynamics simulation which is parameter free. This method is especially appropriate for finite systems in which a periodic boundary condition does not apply. Simulations on carbon nanotubes and Ni nanoparticles clearly demonstrate the validity of the method, from which we can also easily obtain the equations of states for a finite system under external pressure. },
        Author = {D Y Sun and X G Gong},
        Date-Added = {2007-02-05 16:29:44 -0500},
        Date-Modified = {2009-01-25 21:51:31 -0500},
        Journal = {J. Phys.: Condens. Matter},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Sun/2002.pdf},
        Number = {26},
        Pages = {L487-L493},
        Title = {A new constant-pressure molecular dynamics method for finite systems},
        Url = {http://stacks.iop.org/0953-8984/14/L487},
        Volume = {14},
        Year = {2002},
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        Bdsk-Url-1 = {http://stacks.iop.org/0953-8984/14/L487}}

@article{luo:145502,
        Author = {W. K. Luo and H. W. Sheng and F. M. Alamgir and J. M. Bai and J. H. He and E. Ma},
        Date-Added = {2007-01-08 14:00:22 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {145502},
        Journal = {Physical Review Letters},
        Keywords = {silver alloys; nickel alloys; noncrystalline structure; quasicrystals; EXAFS; XANES; Monte Carlo methods},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Luo/2004.pdf},
        Number = {14},
        Numpages = {4},
        Pages = {145502},
        Publisher = {APS},
        Title = {Icosahedral Short-Range Order in Amorphous Alloys},
        Url = {http://link.aps.org/abstract/PRL/v92/e145502},
        Volume = {92},
        Year = {2004},
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        Bdsk-Url-1 = {http://link.aps.org/abstract/PRL/v92/e145502}}

@article{HuangS.-P._jp0204206,
        Affiliation = {Department of Chemical Engineering, University of South Carolina, Columbia, South Carolina 29208},
        Author = {Huang, S.-P. and Balbuena, P.B.},
        Date-Added = {2007-01-08 12:42:05 -0500},
        Date-Modified = {2009-01-25 21:48:02 -0500},
        Issn = {1520-6106},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Huang/2002.pdf},
        Number = {29},
        Pages = {7225-7236},
        Title = {Melting of Bimetallic {C}u-{N}i Nanoclusters},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp0204206},
        Volume = {106},
        Year = {2002},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp0204206}}

@article{Ju:2005qy,
        Address = {National Center for High-Performance Computing, No. 21, Nan-Ke 3rd Road, Hsin-Shi, Tainan, Taiwan, Republic of China},
        Author = {Ju, S. -P. and Lo, Y. -C. and Sun, S. -J. and Chang, J. -G.},
        Date-Added = {2007-01-03 18:29:53 -0500},
        Date-Modified = {2009-01-25 21:45:44 -0500},
        Isbn = {1520-6106},
        Ja = {J. Phys. Chem. B},
        Jo = {Journal of Physical Chemistry B},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Ju/2005.pdf},
        Number = {44},
        Pages = {20805--20809},
        Title = {Investigation on the Structural Variation of Co-Cu Nanoparticles during the Annealing Process},
        Ty = {JOUR},
        Url = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp052803k},
        Volume = {109},
        Year = {2005},
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        Bdsk-Url-1 = {http://pubs3.acs.org/acs/journals/doilookup?in_doi=10.1021/jp052803k}}

@article{luo:131927,
        Author = {W. K. Luo and H. W. Sheng and E. Ma},
        Date-Added = {2007-01-03 18:15:55 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {131927},
        Journal = {Applied Physics Letters},
        Keywords = {molecular dynamics method; amorphous state; alloys},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Luo/2006.pdf},
        Number = {13},
        Numpages = {3},
        Pages = {131927},
        Publisher = {AIP},
        Title = {Pair correlation functions and structural building schemes in amorphous alloys},
        Url = {http://link.aip.org/link/?APL/89/131927/1},
        Volume = {89},
        Year = {2006},
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQF+AAAAAAF+AAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFLZ4IMjAwNi5wZGYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUtoMHBozYAAAAAAAAAAAABAAMAAAkgAAAAAAAAAAAAAAAAAAAAA0x1bwAAEAAIAADEHbuOAAAAEQAIAADBwemGAAAAAQAUAAUtngAFCOEAAw/3AAMP4AAAeY4AAgA4TWFjaW50b3NoIEhEOlVzZXJzOmNoYXJsZXM6RG9jdW1lbnRzOlBhcGVyczpMdW86MjAwNi5wZGYADgASAAgAMgAwADAANgAuAHAAZABmAA8AGgAMAE0AYQBjAGkAbgB0AG8AcwBoACAASABEABIAK1VzZXJzL2NoYXJsZXMvRG9jdW1lbnRzL1BhcGVycy9MdW8vMjAwNi5wZGYAABMAAS8AABUAAgAO//8AANIeHyAhWCRjbGFzc2VzWiRjbGFzc25hbWWjISIjXU5TTXV0YWJsZURhdGFWTlNEYXRhWE5TT2JqZWN0XxAWLi4vUGFwZXJzL0x1by8yMDA2LnBkZtIeHyYnoicjXE5TRGljdGlvbmFyeQAIABEAGgAfACkAMgA3ADoAPwBBAFMAXABiAGkAcAB4AIMAhQCIAIoAjACPAJEAkwCdAKoArwC3ALkCOwJAAkkCVAJYAmYCbQJ2Ao8ClAKXAAAAAAAAAgEAAAAAAAAAKAAAAAAAAAAAAAAAAAAAAqQ=},
        Bdsk-Url-1 = {http://link.aip.org/link/?APL/89/131927/1}}

@article{PhysRevLett.89.075507,
        Author = {Schenk, T. and Holland-Moritz, D. and Simonet, V. and Bellissent, R. and Herlach, D. M.},
        Date-Added = {2007-01-03 18:07:34 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Doi = {10.1103/PhysRevLett.89.075507},
        Journal = {Phys. Rev. Lett.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Schenk/2002.pdf},
        Month = {Jul},
        Number = {7},
        Numpages = {4},
        Pages = {075507},
        Publisher = {American Physical Society},
        Title = {Icosahedral Short-Range Order in Deeply Undercooled Metallic Melts},
        Volume = {89},
        Year = {2002},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevLett.89.075507}}

@article{Ma:2005fk,
        Abstract = {The development and understanding of alloys is one of the most important themes of physical metallurgy. Over the past four decades, the progress in modern processing techniques has enabled researchers to artificially create an increasing number of new alloys in systems that are immiscible in thermodynamic equilibrium. This possibility of alloying elements between which no alloys exist in nature offers exciting opportunities for many physics, chemistry, and materials science endeavors. One of the obvious questions that needs to be answered is exactly what kind of alloys have been, and can be, obtained in these systems with positive heat of mixing, in terms of the uniformity, the presence of short-to-medium range chemical and topological order/clustering, and the energy state of the new alloy phases. This issue was not adequately addressed before because, until recent years, simple diffraction measurements constituted the main method for the characterization of the alloys produced. In this article, we survey the alloys created in binary systems with positive heat of mixing. Our emphasis is on a systematic examination of the atomic-level structure, and calorimetric determination of the positive enthalpy of mixing, of several model binary alloys created between immiscible elements, covering both amorphous and crystalline solid solutions. Vapor-deposited alloys will be our primary focus, but alloys prepared via other processing routes or modeled in computer simulations will also be discussed. The experimental characterization results recently obtained using local environment probes will be reviewed, together with the insight gained through computer atomistic simulations. The local structures uncovered will be correlated directly with the thermodynamic properties. A full account of the thermodynamic and kinetic aspects of the phase selection and the details of the transformation mechanisms involved, on the other hand, is a much broader subject to be dealt with in a separate review.},
        Author = {Ma, E.},
        Date-Added = {2007-01-03 18:04:41 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Progress in Materials Science},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Ma/2005a.pdf},
        Number = {4},
        Pages = {413--509},
        Title = {Alloys created between immiscible elements},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TX1-4DDXN29-1/2/c79892bfea1714067d887cb627ada223},
        Volume = {50},
        Year = {2005},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TX1-4DDXN29-1/2/c79892bfea1714067d887cb627ada223}}

@article{2003RvMP...75..237F,
        Adsnote = {Provided by the Smithsonian/NASA Astrophysics Data System},
        Adsurl = {http://adsabs.harvard.edu/cgi-bin/nph-bib_query?bibcode=2003RvMP...75..237F&db_key=PHY},
        Author = {{Faupel}, F. and {Frank}, W. and {Macht}, M.-P. and {Mehrer}, H. and {Naundorf}, V. and {R{\"a}tzke}, K. and {Schober}, H.~R. and {Sharma}, S.~K. and {Teichler}, H.},
        Date-Added = {2007-01-03 17:57:24 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Doi = {10.1103/RevModPhys.75.237},
        Journal = {Reviews of Modern Physics},
        Month = feb,
        Pages = {237-280},
        Title = {{Diffusion in metallic glasses and supercooled melts}},
        Volume = 75,
        Year = 2003,
        Bdsk-Url-1 = {http://dx.doi.org/10.1103/RevModPhys.75.237}}

@article{KLEMENT:1960lr,
        Annote = {10.1038/187869b0},
        Author = {KLEMENT, W. , and WILLENS, R. H. and DUWEZ, POL},
        Date-Added = {2007-01-03 17:55:00 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Nature},
        M3 = {10.1038/187869b0},
        Number = {4740},
        Pages = {869--870},
        Title = {Non-crystalline Structure in Solidified Gold-Silicon Alloys},
        Ty = {JOUR},
        Url = {http://dx.doi.org/10.1038/187869b0},
        Volume = {187},
        Year = {1960},
        Bdsk-Url-1 = {http://dx.doi.org/10.1038/187869b0}}

@article{Buffat:1976yq,
        Author = {Ph. Buffat and J-P. Borel},
        Date-Added = {2007-01-03 17:50:30 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Phys. Rev. A},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Buffat/1976.pdf},
        Pages = {2287--2298},
        Title = {Size effect on the melting temperature of gold particles},
        Volume = {13},
        Year = {1976},
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@article{De:1996ta,
        Author = {G. De and M. Gusso and L. Tapfer and M. Catalano and F. Gonella and G. Mattei and P. Mazzoldi and G. Battaglin},
        Date-Added = {2007-01-03 17:50:04 -0500},
        Date-Modified = {2009-01-25 21:40:32 -0500},
        Journal = {J. Appl. Phys.},
        Keywords = {COMPOSITE MATERIALS; SILVER; COPPER; SOLID CLUSTERS; SOL&#150;GEL PROCESS; THIN FILMS; SILICA; ABSORPTION SPECTRA; RBS; XRD; TEM},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/De/1996a.pdf},
        Number = {12},
        Pages = {6734-6739},
        Publisher = {AIP},
        Title = {Annealing behavior of silver, copper, and silver--copper nanoclusters in a silica matrix synthesized by the sol-gel technique},
        Url = {http://link.aip.org/link/?JAP/80/6734/1},
        Volume = {80},
        Year = {1996},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JAP/80/6734/1}}

@article{Mazzone:1997pe,
        Author = {G Mazzone and V Rosato},
        Date-Added = {2007-01-03 17:49:53 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Mazzone/1997.pdf},
        Number = {2},
        Pages = {837-842},
        Title = {Molecular-dynamics calculations of thermodynamics properties of metastable alloys},
        Volume = {55},
        Year = {1997},
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@article{Sheng:2002jo,
        Author = {Sheng, H. W. and Wilde, G. and Ma, E.},
        Date-Added = {2007-01-03 17:48:54 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Acta Materialia},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Sheng/2002a.pdf},
        Number = {3},
        Pages = {475-488},
        Title = {The competing crystalline and amorphous solid solutions in the Ag-Cu system},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TW8-44W338F-3/2/3749f32cf6b1a4f8ebea936d508c9f87},
        Volume = {50},
        Year = {2002},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TW8-44W338F-3/2/3749f32cf6b1a4f8ebea936d508c9f87}}

@article{najafabadi:3144,
        Author = {R. Najafabadi and D. J. Srolovitz and E. Ma and M. Atzmon},
        Date-Added = {2007-01-03 17:48:54 -0500},
        Date-Modified = {2009-01-25 21:40:08 -0500},
        Journal = {J. Appl. Phys.},
        Keywords = {SILVER ALLOYS; COPPER ALLOYS; THERMODYNAMIC PROPERTIES; PHASE DIAGRAMS; COMPUTERIZED SIMULATION; CALORIMETRY; BINARY ALLOY SYSTEMS; FORMATION FREE ENTHALPY; LATTICE PARAMETERS; METASTABLE PHASES},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Najafabadi/1993.pdf},
        Number = {5},
        Pages = {3144-3149},
        Publisher = {AIP},
        Title = {Thermodynamic properties of metastable Ag-Cu alloys},
        Url = {http://link.aip.org/link/?JAP/74/3144/1},
        Volume = {74},
        Year = {1993},
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@article{duwez:1136,
        Author = {Pol Duwez and R. H. Willens and W. Klement and Jr},
        Date-Added = {2007-01-03 17:48:02 -0500},
        Date-Modified = {2009-01-25 21:02:45 -0500},
        Journal = {J. Appl. Phys.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Duwez/1960.pdf},
        Number = {6},
        Pages = {1136-1137},
        Publisher = {AIP},
        Title = {Continuous Series of Metastable Solid Solutions in Silver-Copper Alloys},
        Url = {http://link.aip.org/link/?JAP/31/1136/2},
        Volume = {31},
        Year = {1960},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JAP/31/1136/2}}

@article{Banhart:1992sv,
        Author = {J Banhart and H Ebert and R Kuentzler and J Voitl\"{a}nder},
        Date-Added = {2007-01-03 17:48:02 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Banhart/1992.pdf},
        Number = {16},
        Pages = {9968-9975},
        Title = {Electronic properties of single-phased metastable Ag-Cu alloys},
        Volume = {46},
        Year = {1992},
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@article{PhysRevB.67.155409,
        Author = {Gaudry, M. and Cottancin, E. and Pellarin, M. and Lerm\'e, J. and Arnaud, L. and Huntzinger, J. R. and Vialle, J. L. and Broyer, M. and Rousset, J. L. and Treilleux, M. and M\'elinon, P.},
        Date-Added = {2007-01-03 12:01:53 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Doi = {10.1103/PhysRevB.67.155409},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Gaudry/2003.pdf},
        Month = {Apr},
        Number = {15},
        Numpages = {10},
        Pages = {155409},
        Publisher = {American Physical Society},
        Title = {Size and composition dependence in the optical properties of mixed (transition metal/noble metal) embedded clusters},
        Volume = {67},
        Year = {2003},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.67.155409}}

@article{rapallo:194308,
        Author = {Arnaldo Rapallo and Giulia Rossi and Riccardo Ferrando and Alessandro Fortunelli and Benjamin C. Curley and Lesley D. Lloyd and Gary M. Tarbuck and Roy L. Johnston},
        Date-Added = {2006-12-30 15:20:37 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {194308},
        Journal = {The Journal of Chemical Physics},
        Keywords = {genetic algorithms; metal clusters; nanostructured materials; surface segregation; surface composition; optimisation; silver alloys; copper alloys; gold alloys; nickel alloys; chemical analysis},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Rapallo/2005.pdf},
        Number = {19},
        Numpages = {13},
        Pages = {194308},
        Publisher = {AIP},
        Title = {Global optimization of bimetallic cluster structures. I. Size-mismatched Ag--Cu, Ag--Ni, and Au--Cu systems},
        Url = {http://link.aip.org/link/?JCP/122/194308/1},
        Volume = {122},
        Year = {2005},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/122/194308/1}}

@article{cheng:064117,
        Author = {Daojian Cheng and Shiping Huang and Wenchuan Wang},
        Date-Added = {2006-12-30 15:19:11 -0500},
        Date-Modified = {2009-01-25 21:47:53 -0500},
        Eid = {064117},
        Journal = {Phys. Rev. B},
        Keywords = {copper alloys; gold alloys; metal clusters; melting; melting point; Monte Carlo methods; tight-binding calculations; specific heat; bond lengths; fluctuations; deformation; doping; surface segregation},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Cheng/2006.pdf},
        Number = {6},
        Numpages = {11},
        Pages = {064117},
        Publisher = {APS},
        Title = {Thermal behavior of core-shell and three-shell layered clusters: Melting of Cu[sub 1]Au[sub 54] and Cu[sub 12]Au[sub 43]},
        Url = {http://link.aps.org/abstract/PRB/v74/e064117},
        Volume = {74},
        Year = {2006},
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        Bdsk-Url-1 = {http://link.aps.org/abstract/PRB/v74/e064117}}

@article{rossi:105503,
        Author = {G. Rossi and A. Rapallo and C. Mottet and A. Fortunelli and F. Baletto and R. Ferrando},
        Date-Added = {2006-12-30 15:12:42 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {105503},
        Journal = {Physical Review Letters},
        Keywords = {metal clusters; nanoparticles; genetic algorithms; density functional theory; molecular dynamics method; potential energy functions; thermal stability; silver; nickel; copper; melting point; energy gap},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Rossi/2004.pdf},
        Number = {10},
        Numpages = {4},
        Pages = {105503},
        Publisher = {APS},
        Title = {Magic Polyicosahedral Core-Shell Clusters},
        Url = {http://link.aps.org/abstract/PRL/v93/e105503},
        Volume = {93},
        Year = {2004},
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        Bdsk-Url-1 = {http://link.aps.org/abstract/PRL/v93/e105503}}

@article{Hu:2005lr,
        Author = {Wangyu Hu and Shifang Xiao and Jianyu Yang and Zhi Zhang},
        Date-Added = {2006-12-30 15:06:16 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {The European Physical Journal B - Condensed Matter and Complex Systems},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Hu/2005.pdf},
        M3 = {10.1140/epjb/e2005-00210-8},
        Number = {4},
        Pages = {547--554},
        Title = {Melting evolution and diffusion behavior of vanadium nanoparticles},
        Ty = {JOUR},
        Url = {http://dx.doi.org/10.1140/epjb/e2005-00210-8},
        Volume = {V45},
        Year = {2005},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1140/epjb/e2005-00210-8}}

@article{calvo:125414,
        Author = {F. Calvo and J. P. K. Doye},
        Date-Added = {2006-12-27 11:36:45 -0500},
        Date-Modified = {2009-01-25 21:49:52 -0500},
        Eid = {125414},
        Journal = {Phys. Rev. B},
        Keywords = {metal clusters; nanostructured materials; phase diagrams; free energy; high-pressure effects},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Calvo/2004.pdf},
        Number = {12},
        Numpages = {6},
        Pages = {125414},
        Publisher = {APS},
        Title = {Pressure effects on the structure of nanoclusters},
        Url = {http://link.aps.org/abstract/PRB/v69/e125414},
        Volume = {69},
        Year = {2004},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aps.org/abstract/PRB/v69/e125414}}

@article{Baltazar:2006lr,
        Abstract = {A compilation and an implementation of different methodologies to simulate NPT ensembles on finite systems is presented. In general, the methods discussed can be classified in two different groups depending on how the external pressure is applied to the system. The first approach is based on including the pressure with its conjugate thermodynamical variable, the volume, in the Lagrangian of the system. For this group four different volume definitions were considered and we assess their validity by studying the structural properties of small systems as function of pressure. In particular, we focus on the stability of the C60 molecule as well as the amorphization process of a diamond-like cluster under pressure. In the second group, the finite system (C60) is embedded in a classical fluid which serves as a pressure reservoir. We take the latter method as reference because it is closest to the experimental situation. The difficulties and the regimes where these methods can be used are also discussed.},
        Author = {Baltazar, S. E. and Romero, A. H. and Rodriguez-Lopez, J. L. and Terrones, H. and Martonak, R.},
        Date-Added = {2006-12-14 16:25:59 -0500},
        Date-Modified = {2009-01-25 21:49:25 -0500},
        Journal = {Comp. Mat. Sci.},
        Keywords = {High pressures, Finite systems, Volume, Molecular dynamics},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Baltazar/2006a.pdf},
        Number = {4},
        Pages = {526--536},
        Title = {Assessment of isobaric-isothermal (NPT) simulations for finite systems},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TWM-4J72YTH-1/2/47e99bb33e4cf899d96bcf83966fc4be},
        Volume = {37},
        Year = {2006},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TWM-4J72YTH-1/2/47e99bb33e4cf899d96bcf83966fc4be}}

@article{Kohanoff:2005,
        Author = {Kohanoff, J and Caro, A and Finnis, MW},
        Date = {SEP 5},
        Date-Added = {2006-12-14 16:21:21 -0500},
        Date-Modified = {2009-01-25 21:51:08 -0500},
        Journal = {Chem. Phys. Chem.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Kohanoff/2005.pdf},
        Number = 9,
        Pages = {1848 - 1852},
        Title = {An isothermal-isobaric Langevin thermostat for simulating nanoparticles under pressure: Application to {A}u clusters},
        Volume = 6,
        Year = 2005,
        Bdsk-File-1 = {YnBsaXN0MDDUAQIDBAUGCQpYJHZlcnNpb25UJHRvcFkkYXJjaGl2ZXJYJG9iamVjdHMSAAGGoNEHCFRyb290gAFfEA9OU0tleWVkQXJjaGl2ZXKoCwwXGBkdJCVVJG51bGzTDQ4PEBEUViRjbGFzc1dOUy5rZXlzWk5TLm9iamVjdHOAB6ISE4ACgAOiFRaABIAGWWFsaWFzRGF0YVxyZWxhdGl2ZVBhdGjSDRobHFdOUy5kYXRhgAVPEQGMAAAAAAGMAAIAAAxNYWNpbnRvc2ggSEQAAAAAAAAAAAAAAAAAAADEHYNOSCsAAAAFLYcIMjAwNS5wZGYAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAUtiMGnHaEAAAAAAAAAAAABAAMAAAkgAAAAAAAAAAAAAAAAAAAACEtvaGFub2ZmABAACAAAxB27jgAAABEACAAAwadj8QAAAAEAFAAFLYcABQjhAAMP9wADD+AAAHmOAAIAPU1hY2ludG9zaCBIRDpVc2VyczpjaGFybGVzOkRvY3VtZW50czpQYXBlcnM6S29oYW5vZmY6MjAwNS5wZGYAAA4AEgAIADIAMAAwADUALgBwAGQAZgAPABoADABNAGEAYwBpAG4AdABvAHMAaAAgAEgARAASADBVc2Vycy9jaGFybGVzL0RvY3VtZW50cy9QYXBlcnMvS29oYW5vZmYvMjAwNS5wZGYAEwABLwAAFQACAA7//wAA0h4fICFYJGNsYXNzZXNaJGNsYXNzbmFtZaMhIiNdTlNNdXRhYmxlRGF0YVZOU0RhdGFYTlNPYmplY3RfEBsuLi9QYXBlcnMvS29oYW5vZmYvMjAwNS5wZGbSHh8mJ6InI1xOU0RpY3Rpb25hcnkACAARABoAHwApADIANwA6AD8AQQBTAFwAYgBpAHAAeACDAIUAiACKAIwAjwCRAJMAnQCqAK8AtwC5AkkCTgJXAmICZgJ0AnsChAKiAqcCqgAAAAAAAAIBAAAAAAAAACgAAAAAAAAAAAAAAAAAAAK3}}

@article{0953-8984-18-39-037,
        Abstract = {We report a classical molecular dynamics isothermal\&ndash;isobaric ensemble ( NPT ) implementation for the simulation of pressure effects on finite systems. The method is based on calculating the enclosed surface area by means of the Delauney triangulation method, which results in a fairly accurate description of the surface and the system volume. The external pressure is applied to the system by external forces acting on the triangulated surface covering the nanostructure. Pressure is exerted perpendicularly to every one of the Delauney triangles, by equally distributing the force to every corner of a triangle. We applied the method to finite single wall capped carbon nanotubes (SWCNTs) with different chiralities and different tube lengths ranging from 4~nm up to 30~nm. Pressure effects are studied as a function of the radii and the nanotube length, as well as as a function of temperature. Our results are in very good agreement when compared with both experimental and other theoretical results. },
        Author = {S E Baltazar and A H Romero and J L Rodr\'{i}guez-L\'{o}pez and R Marto\&ncaron;\'{a}k},
        Date-Added = {2006-12-14 15:23:48 -0500},
        Date-Modified = {2009-01-25 21:49:03 -0500},
        Journal = {J. Phys.: Condens. Matter},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Baltazar/2006.pdf},
        Number = {39},
        Pages = {9119-9128},
        Title = {Finite single wall capped carbon nanotubes under hydrostatic pressure},
        Url = {http://stacks.iop.org/0953-8984/18/9119},
        Volume = {18},
        Year = {2006},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://stacks.iop.org/0953-8984/18/9119}}

@article{PhysRevB.63.193412,
        Author = {Sun, D. Y. and Gong, X. G. and Wang, Xiao-Qian},
        Date-Added = {2006-12-14 15:08:18 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Doi = {10.1103/PhysRevB.63.193412},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Sun/2001.pdf},
        Month = {May},
        Number = {19},
        Numpages = {4},
        Pages = {193412},
        Publisher = {American Physical Society},
        Title = {Soft and hard shells in metallic nanocrystals},
        Volume = {63},
        Year = {2001},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1103/PhysRevB.63.193412}}

@book{Leach:1996kx,
        Author = {Andrew R. Leach},
        Date-Added = {2006-11-29 19:03:23 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Publisher = {Addison-Wesley Pub. Co.},
        Title = {Molecular Modelling: Principles and Applications},
        Year = {1996}}

@article{Chen90,
        Author = {A.~P. Sutton and J. Chen},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Phil. Mag. Lett.},
        Pages = {139-146},
        Title = {Long-Range Finnis Sinclair Potentials},
        Volume = 61,
        Year = {1990}}

@article{Meineke:2004uq,
        Author = {Meineke, Matthew A. and Vardeman II, Charles F. and Teng Lin and Christopher J. Fennell and J. Daniel Gezelter},
        Date-Added = {2006-11-27 18:09:52 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {J. Comp Chem},
        Number = {3},
        Pages = {252-271},
        Title = {{OOPSE:} An object-oriented parallel simulation engine for molecular dynamics},
        Volume = {26},
        Year = {2005}}

@book{asmvol3,
        Date-Added = {2006-11-27 14:49:12 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Publisher = {ASM},
        Title = {ASM Handbook Volume 03: Alloy Phase Diagrams},
        Year = {1992}}

@article{swygenhoven:1652,
        Author = {H. Van Swygenhoven and A. Caro},
        Date-Added = {2006-11-16 18:15:30 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Applied Physics Letters},
        Keywords = {nickel; plastic deformation; grain size; slip; molecular dynamics method; nanostructured materials},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Swygenhoven/1997.pdf},
        Number = {12},
        Pages = {1652-1654},
        Publisher = {AIP},
        Title = {Plastic behavior of nanophase Ni: A molecular dynamics computer simulation},
        Url = {http://link.aip.org/link/?APL/71/1652/1},
        Volume = {71},
        Year = {1997},
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        Bdsk-Url-1 = {http://link.aip.org/link/?APL/71/1652/1}}

@article{xiao:184504,
        Author = {Shifang Xiao and Wangyu Hu and Jianyu Yang},
        Date-Added = {2006-11-16 18:06:31 -0500},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {184504},
        Journal = {The Journal of Chemical Physics},
        Keywords = {silver; melting point; grain size; nanostructured materials; amorphous state; grain boundaries; computational geometry; molecular dynamics method},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Xiao/2006.pdf},
        Number = {18},
        Numpages = {4},
        Pages = {184504},
        Publisher = {AIP},
        Title = {Melting temperature: From nanocrystalline to amorphous phase},
        Url = {http://link.aip.org/link/?JCP/125/184504/1},
        Volume = {125},
        Year = {2006},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/125/184504/1}}

@article{Chen:2004ec,
        Abstract = {Thermodynamic and structural properties of supercooled nanoclusters are of considerable interest. A numerical study of a gold nanocluster with 2112 atoms based on molecular dynamics simulation demonstrates how the cooling conditions affect the microstructures of nanoclusters. Structural parameters like pair correlation function, pair analysis and bond orientation-order parameters are used to investigate the structure transition of an Au nanocluster. The result shows that an Au nanocluster will evolve into a different microstructure under different cooling processes. At a cooling rate of 1.5625 $\times$ 10$^{13}$\&thinsp;K\&thinsp;s$^{\&minus;1}$, the nanocluster forms an amorphous type structure. At a lower cooling rate of 1.5625 $\times$ 10$^{12}$\&thinsp;K\&thinsp;s$^{\&minus;1}$, the system transforms from a supercooled liquid into a crystal-like structure. By looking into the bonded pairs within the cluster, the rearrangement of the Au nanocluster should be responsible for the structural evolution. },
        Author = {Ying Chen and Xiufang Bian and Jingxiang Zhang and Yanning Zhang and Li Wang},
        Date-Added = {2006-09-25 12:21:05 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Modelling and Simulation in Materials Science and Engineering},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Chen/2004.pdf},
        Number = {3},
        Pages = {373-379},
        Title = {Structure and dynamics of gold nanocluster under cooling conditions},
        Url = {http://stacks.iop.org/0965-0393/12/373},
        Volume = {12},
        Year = {2004},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://stacks.iop.org/0965-0393/12/373}}

@article{HuM._jp020581+,
        Author = {Hu, M. and Hartland, G.V.},
        Date-Added = {2006-09-24 23:11:31 -0400},
        Date-Modified = {2009-01-25 21:35:51 -0500},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp020581+.pdf},
        Number = {28},
        Pages = {7029-7033},
        Title = {Heat Dissipation for {A}u Particles in Aqueous Solution: Relaxation Time versus Size},
        Url = {http://dx.doi.org/10.1021/jp020581+},
        Volume = {106},
        Year = {2002},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/jp020581+}}

@article{plech:195423,
        Author = {A. Plech and V. Kotaidis and S. Gresillon and C. Dahmen and G. von Plessen},
        Date-Added = {2006-09-24 23:08:07 -0400},
        Date-Modified = {2007-03-24 12:37:59 -0400},
        Eid = {195423},
        Journal = {Phys. Rev. B},
        Keywords = {gold; laser materials processing; melting; nanoparticles; time resolved spectra; X-ray scattering; lattice dynamics; high-speed optical techniques; cooling; thermal resistance; thermal conductivity; long-range order},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/PhysRevB_70_195423.pdf},
        Number = {19},
        Numpages = {7},
        Pages = {195423},
        Publisher = {APS},
        Title = {Laser-induced heating and melting of gold nanoparticles studied by time-resolved x-ray scattering},
        Url = {http://link.aps.org/abstract/PRB/v70/e195423},
        Volume = {70},
        Year = {2004},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aps.org/abstract/PRB/v70/e195423}}

@article{kotaidis:184702,
        Author = {V. Kotaidis and C. Dahmen and G. von Plessen and F. Springer and A. Plech},
        Date-Added = {2006-09-24 23:05:26 -0400},
        Date-Modified = {2009-01-25 21:44:46 -0500},
        Eid = {184702},
        Journal = {J. Chem. Phys.},
        Keywords = {gold; nanoparticles; water; laser beam effects; surface collisions; bubbles; evaporation; X-ray scattering},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_124_184702.pdf},
        Number = {18},
        Numpages = {7},
        Pages = {184702},
        Publisher = {AIP},
        Title = {Excitation of nanoscale vapor bubbles at the surface of gold nanoparticles in water},
        Url = {http://link.aip.org/link/?JCP/124/184702/1},
        Volume = {124},
        Year = {2006},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/124/184702/1}}

@article{ShibataT._ja026764r,
        Author = {Shibata, T. and Bunker, B.A. and Zhang, Z. and Meisel, D. and Vardeman, C.F. and Gezelter, J.D.},
        Date-Added = {2006-09-24 22:35:30 -0400},
        Date-Modified = {2009-01-25 21:28:43 -0500},
        Journal = {J. Am. Chem. Soc.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/ja026764r.pdf},
        Number = {40},
        Pages = {11989-11996},
        Title = {Size-Dependent Spontaneous Alloying of {A}u-{A}g Nanoparticles},
        Url = {http://dx.doi.org/10.1021/ja026764r},
        Volume = {124},
        Year = {2002},
        Bdsk-File-1 = {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},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/ja026764r}}

@article{qian:4514,
        Author = {J. Qian and R. Hentschke and A. Heuer},
        Date-Added = {2006-09-24 22:06:58 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {The Journal of Chemical Physics},
        Keywords = {organic compounds; molecular dynamics method; molecular reorientation; glass},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_110_4514.pdf},
        Number = {9},
        Pages = {4514-4522},
        Publisher = {AIP},
        Title = {Dynamic heterogeneities of translational and rotational motion of a molecular glass former from computer simulations},
        Url = {http://link.aip.org/link/?JCP/110/4514/1},
        Volume = {110},
        Year = {1999},
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@article{garrison:041501,
        Author = {Barbara J. Garrison and Tatiana E. Itina and Leonid V. Zhigilei},
        Date-Added = {2006-09-23 18:10:42 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {041501},
        Journal = {Physical Review E (Statistical, Nonlinear, and Soft Matter Physics)},
        Keywords = {laser ablation; nucleation; molecular dynamics method; digital simulation; enthalpy},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/PhysRevE_68_041501.pdf},
        Number = {4},
        Numpages = {4},
        Pages = {041501},
        Publisher = {APS},
        Title = {Limit of overheating and the threshold behavior in laser ablation},
        Url = {http://link.aps.org/abstract/PRE/v68/e041501},
        Volume = {68},
        Year = {2003},
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        Bdsk-Url-1 = {http://link.aps.org/abstract/PRE/v68/e041501}}

@article{DouY._jp003913o,
        Author = {Dou, Y. and Zhigilei, L.V. and Winograd, N. and Garrison, B.J.},
        Date-Added = {2006-09-23 18:02:53 -0400},
        Date-Modified = {2009-01-25 21:52:28 -0500},
        Journal = {J. Phys. Chem. A},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/jp003913o.pdf},
        Number = {12},
        Pages = {2748-2755},
        Title = {Explosive Boiling of Water Films Adjacent to Heated Surfaces: A Microscopic Description},
        Url = {http://dx.doi.org/10.1021/jp003913o},
        Volume = {105},
        Year = {2001},
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        Bdsk-Url-1 = {http://dx.doi.org/10.1021/jp003913o}}

@misc{ganesh-2006-,
        Author = {P. Ganesh and M. Widom},
        Date-Added = {2006-09-22 14:21:33 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/ico_cu.pdf},
        Title = {Signature of nearly icosahedral structures in liquid and supercooled liquid Copper},
        Url = {http://www.citebase.org/abstract?id=oai:arXiv.org:cond-mat/0602239},
        Year = {2006},
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        Bdsk-Url-1 = {http://www.citebase.org/abstract?id=oai:arXiv.org:cond-mat/0602239}}

@article{wolde:9932,
        Author = {Pieter Rein ten Wolde and Maria J. Ruiz-Montero and Daan Frenkel},
        Date-Added = {2006-09-22 14:12:18 -0400},
        Date-Modified = {2007-03-24 12:28:27 -0400},
        Journal = {J. Chem. Phys.},
        Keywords = {NUCLEATION; CRYSTALLIZATION; LENNARD&#150;JONES POTENTIAL; COMPUTERIZED SIMULATION; FCC LATTICES; BCC LATTICES; CRITICAL SIZE; ORDER PARAMETERS; SOLID&#150;FLUID INTERFACES; MOLECULAR DYNAMICS CALCULATIONS; REACTION RATES},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/JChemPhys_104_9932.pdf},
        Number = {24},
        Pages = {9932-9947},
        Publisher = {AIP},
        Title = {Numerical calculation of the rate of crystal nucleation in a Lennard-Jones system at moderate undercooling},
        Url = {http://link.aip.org/link/?JCP/104/9932/1},
        Volume = {104},
        Year = {1996},
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        Bdsk-Url-1 = {http://link.aip.org/link/?JCP/104/9932/1}}

@article{Cleveland:1997gu,
        Author = {Charles L. Cleveland and Uzi Landman and Marat N. Shafigullin and Peter W. Stephens and Robert L. Whetten},
        Date-Added = {2006-09-22 14:07:59 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Z. Phys. D},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Cleveland/1997.pdf},
        Pages = {503-508},
        Title = {Structural evolution of larger gold clusters},
        Volume = {40},
        Year = {1997},
        Bdsk-File-1 = {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}}

@article{Breaux:rz,
        Author = {Gary A. Breaux and Baopeng Cao and Martin F. Jarrold},
        Date-Added = {2006-09-22 14:07:40 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Breaux/2005.pdf},
        Title = {Second-Order Phase Transitions in Amorphous Gallium Clusters},
        Volume = {10.1021/jp052887x},
        Year = {2005},
        Bdsk-File-1 = {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}}

@article{Magruder:1994rg,
        Author = {Magruder, III, R. H. and Osborne, Jr. , D. H. and Zuhr, R. A.},
        Date-Added = {2006-09-22 14:07:26 -0400},
        Date-Modified = {2009-01-25 21:41:25 -0500},
        Journal = {J. Non-Cryst. Solids},
        Number = {2-3},
        Pages = {299 --303},
        Title = {Non-linear optical properties of nanometer dimension {A}g-{C}u particles in silica formed by sequential ion implantation},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TXM-48N5KMY-112/2/0e487c2fae5720cdcda8b63ff74b819f},
        Volume = {176},
        Year = {1994},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TXM-48N5KMY-112/2/0e487c2fae5720cdcda8b63ff74b819f}}

@article{BenjaminGilbert07302004,
        Abstract = {Nanoparticles may contain unusual forms of structural disorder that can substantially modify materials properties and thus cannot solely be considered as small pieces of bulk material. We have developed a method to quantify intermediate-range order in 3.4-nanometer-diameter zinc sulfide nanoparticles and show that structural coherence is lost over distances beyond 2nanometers. The zinc-sulfur Einstein vibration frequency in the nanoparticles is substantially higher than that in the bulk zinc sulfide, implying structural stiffening. This cannot be explained by the observed 1% radial compression and must be primarily due to inhomogeneous internal strain caused by competing relaxations from an irregular surface. The methods developed here are generally applicable to the characterization of nanoscale solids, many of which may exhibit complex disorder and strain.
},
        Author = {Gilbert, Benjamin and Huang, Feng and Zhang, Hengzhong and Waychunas, Glenn A. and Banfield, Jillian F.},
        Date-Added = {2006-09-22 14:07:15 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eprint = {http://www.sciencemag.org/cgi/reprint/305/5684/651.pdf},
        Journal = {Science},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Gilbert/2004b.pdf},
        Number = {5684},
        Pages = {651-654},
        Title = {Nanoparticles: Strained and Stiff},
        Url = {http://www.sciencemag.org/cgi/content/abstract/305/5684/651},
        Volume = {305},
        Year = {2004},
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        Bdsk-Url-1 = {http://www.sciencemag.org/cgi/content/abstract/305/5684/651}}

@article{sheng:184203,
        Author = {H. W. Sheng and J. H. He and E. Ma},
        Date-Added = {2006-09-22 14:07:07 -0400},
        Date-Modified = {2007-05-16 14:58:31 -0400},
        Eid = {184203},
        Journal = {Phys. Rev. B},
        Keywords = {silver alloys; copper alloys; rapid solidification; quenching (thermal); molecular dynamics method; crystal structure; amorphous state; short-range order},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Sheng/2002.pdf},
        Number = {18},
        Numpages = {10},
        Pages = {184203},
        Publisher = {APS},
        Title = {Molecular dynamics simulation studies of atomic-level structures in rapidly quenched Ag-Cu nonequilibrium alloys},
        Url = {http://link.aps.org/abstract/PRB/v65/e184203},
        Volume = {65},
        Year = {2002},
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@article{Chushak:2001ry,
        Author = {Y G Chushak and L S Bartell},
        Date-Added = {2006-09-22 14:07:00 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Chushak/2001.pdf},
        Number = {47},
        Pages = {11605-11614},
        Title = {Melting and Freezing of Gold Nanoclusters},
        Volume = {105},
        Year = {2001},
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@article{Hodak:2000rb,
        Author = {Jos\'{e} H. Hodak and Arnim Henglein and Michael Giersig and Gregory V. Hartland},
        Date-Added = {2006-09-22 14:06:51 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {J. Phys. Chem. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Hodak/2000.pdf},
        Pages = {11708 - 11718},
        Title = {Laser-Induced Inter-Diffusion in {A}u{A}g Core-Shell Nanoparticles},
        Volume = {104},
        Year = {2000},
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@article{Gafner:2004bg,
        Author = {Yu. Ya. Gafner and S. L. Gafner and P. Entel},
        Date-Added = {2006-09-22 14:06:33 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Phys. Sol. State},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Gafner/2004a.pdf},
        Number = {7},
        Pages = {1327--1330},
        Title = {Formation of an Icosahedral Structure during Crystallization of Nickel Nanoclusters},
        Volume = {46},
        Year = {2004},
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@article{he:125507,
        Author = {J. H. He and H. W. Sheng and J. S. Lin and P. J. Schilling and R. C. Tittsworth and E. Ma},
        Date-Added = {2006-09-22 14:06:29 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Eid = {125507},
        Journal = {Physical Review Letters},
        Keywords = {solid solutions; silver alloys; copper alloys; quenching (thermal); EXAFS; X-ray scattering; solubility; simulation},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/He/2002.pdf},
        Number = {12},
        Numpages = {4},
        Pages = {125507},
        Publisher = {APS},
        Title = {Homogeneity of a Supersaturated Solid Solution},
        Url = {http://link.aps.org/abstract/PRL/v89/e125507},
        Volume = {89},
        Year = {2002},
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        Bdsk-Url-1 = {http://link.aps.org/abstract/PRL/v89/e125507}}

@article{Vardeman-II:2001jn,
        Author = {C.~F. {Vardeman II} and J.~D. Gezelter},
        Date-Added = {2006-09-22 14:05:53 -0400},
        Date-Modified = {2007-03-12 17:38:32 -0400},
        Journal = {J. Phys. Chem. A},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Vardeman%20II/2001.pdf},
        Number = {12},
        Pages = {2568},
        Title = {Comparing models for diffusion in supercooled liquids: The eutectic composition of the {A}g-{C}u alloy},
        Volume = {105},
        Year = {2001},
        Bdsk-File-1 = {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}}

@article{Steinhardt:1983mo,
        Author = {P. J. Steinhardt and D. R. Nelson and M. Ronchetti},
        Date-Added = {2006-09-22 14:05:49 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Phys. Rev. B},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/1983.pdf},
        Number = {2},
        Pages = {784-804},
        Title = {Bond-Orientational order in liquids and glasses},
        Volume = {28},
        Year = {1983},
        Bdsk-File-1 = {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}}

@book{Massalski:1986kl,
        Date-Added = {2006-09-22 14:05:43 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Editor = {T B Massalski},
        Publisher = {Materials Park, OH: American Society for Metals},
        Title = {Binary alloy phase diagrams},
        Volume = {1-3},
        Year = {1986}}

@article{Ascencio:2000qy,
        Author = {Ascencio, Jorge A. and Perez, Mario and Jose-Yacaman, Miguel},
        Date-Added = {2006-09-22 14:05:27 -0400},
        Date-Modified = {2007-02-16 15:23:00 -0500},
        Journal = {Surface Science},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/Ascencio/2000.pdf},
        Number = {1-3},
        Pages = {73 --80},
        Title = {A truncated icosahedral structure observed in gold nanoparticles},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TVX-3YKKDPN-F/2/18d016014a0c4b12954cb264d8688ecc},
        Volume = {447},
        Year = {2000},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TVX-3YKKDPN-F/2/18d016014a0c4b12954cb264d8688ecc}}

@article{Spohr:1995lr,
        Abstract = {A simple model for the interaction potential of water with a solid surface is proposed. Adsorption energy, surface structure, corrugation, and the orientational anisotropy of the interaction can be varied. The model is used to determine the dependence of the water/metal interfacial structure as a function of the adsorption energy. Adsorption of an iodide ion from the solution onto the surface is studied for two different water adsorption energies. The results confirm the interpretations of previous simulations, namely that the repulsive solvent contribution to the free energy of iodide adsorption is mostly due to the steric displacement of adsorbed water molecules.},
        Author = {Spohr, E.},
        Date-Added = {2006-08-21 18:29:05 -0400},
        Date-Modified = {2009-01-25 21:51:57 -0500},
        Journal = {J. Mol. Liq.},
        Local-Url = {file://localhost/Users/charles/Documents/Papers/sdarticle.pdf},
        Number = {1-2},
        Pages = {91--100},
        T2 = {Ultrafast Phenomena in Liquids and Glasses},
        Title = {Ion adsorption on metal surfaces. The role of water-metal interactions},
        Ty = {JOUR},
        Url = {http://www.sciencedirect.com/science/article/B6TGR-4002H6G-G/2/7b778ec712c1e86796cf919249d0f6a7},
        Volume = {64},
        Year = {1995},
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        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/B6TGR-4002H6G-G/2/7b778ec712c1e86796cf919249d0f6a7}}

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                <string>http://dx.doi.org/10.1039/b312640b,LarsonI._la970029p,PillaiZ.S._jp037018r</string>
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        <dict>
                <key>group name</key>
                <string>Cu-Ag glass</string>
                <key>keys</key>
                <string>duwez:1136,PhysRevB.59.3527,Sheng:2002jo,Mazzone:1997pe,Banhart:1992sv,najafabadi:3144</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Cu-Ag-Au clusters-theory</string>
                <key>keys</key>
                <string>luo:145502,rossi:105503,cheng:064117,Chen:2004ec,Chushak:2001ry,Breaux:rz,rapallo:194308,ganesh-2006-,Hu:2005lr</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Effective Medium Theory</string>
                <key>keys</key>
                <string>Jacobsen:1987p1751,Manninen:1986p1756,Nrskov:1980p1752,Nrskov:1982p1753,Puska:1981p1755,Stott:1980p1754</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>H. C. Andersen</string>
                <key>keys</key>
                <string>Kob95b,Kob95a</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Icosahedral Order</string>
                <key>keys</key>
                <string>19521106,Balucani:1990fk,PhysRevLett.60.2295,PhysRevLett.56.1168,Steinhardt:1983mo,luo:131927,Waal:1995lr,HOARE:1976fk,turnbull:411,hsu:4974,PhysRevLett.53.1951,ganesh-2006-,PhysRevLett.91.135505,19871127</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Integrators</string>
                <key>keys</key>
                <string>Baltazar:2006lr,Kohanoff:2005,0953-8984-14-26-101</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Melting-surface</string>
                <key>keys</key>
                <string>MainardiD.S._la0014306,sankaranarayanan:155441,cheng:064117,PhysRevB.59.15990,Ramirez-Caballero:2006lr,HuangS.-P._jp0204206,kay:5120,mendez-villuendas:185503,Zhu:1997lr</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Metal-Water Surface</string>
                <key>keys</key>
                <string>kay:5120,SpohrE._j100353a043</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Metallic Glass</string>
                <key>keys</key>
                <string>Zwanzig83,Stillinger95,Gaukel98,Blumen83,Rabani2000,Gezelter99,Rabani99,Tolman20,Weber84,Stillinger83,Kob95b,Truhlar00,Lewis91,Hansen86,Rabani97,Tolman27,Belonoshko00,Alemany98,Stillinger82,Klafter96,Lu97,Zwanzig88,Truhlar78,Wendt78,Peker93,Berne90,Qi99,Gezelter97,Parkhurst75a,Shlesinger99,Parkhurst75b,Liu92,Gezelter98a,Stillinger98,Stillinger85,Ngai81,Kob95a,Klafter94,Nagel96</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>nanodiff</string>
                <key>keys</key>
                <string>SOLLIARD:1985p2137,Chen:1997p2142,GOLDSTEIN:1992p2138,MULVANEY:1993p2409,Pawlow:1909p2134,HAASE:1992p2139,Buffat:1976yq,Kohlrausch:1863zv,HengleinA._la981278w,yasuda:1100,Frenkel:2000p2400,Das:1999p2397,Tu:1992uq,TOLBERT:1996p2141,YASUDA:1996p2387,MORI:1991p2144,Hodak:2000rb,Link:1999p2468,MORI:1994p2372,JOHNSON:1989p2479,PhysRevLett.69.3747,HENGLEIN:1999p2419</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Nanoparticle Thermal</string>
                <key>keys</key>
                <string>PhysRevB.66.224301</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>NPT Langevin</string>
                <key>keys</key>
                <string>Buscaglia:1997fk,calvo:125414,Baltazar:2006lr,0953-8984-18-39-037,0953-8984-14-26-101,Kohanoff:2005,0031-9155-41-9-016</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Pair Analysis</string>
                <key>keys</key>
                <string>Iwamatsu:2007lr,Miracle:2006qy,PhysRevLett.60.2295,HoneycuttJ.Dana_j100303a014</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Surface Tension</string>
                <key>keys</key>
                <string>0957-0233-16-2-015,neubauer:046106,Chen:2001qy,PhysRevLett.75.4043,0965-0393-7-2-005</string>
        </dict>
        <dict>
                <key>group name</key>
                <string>Thiol-Metal</string>
                <key>keys</key>
                <string>LuedtkeW.D._jp981745i,LuedtkeW.D._jp961721g,MahaffyR._jp962281w</string>
        </dict>
</array>
</plist>
}}
Revision:	3496
Committed:	Wed Apr 8 19:13:41 2009 UTC (15 years, 5 months ago) by chuckv
File size:	385639 byte(s)
Log Message:	Final Version