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1 chrisfen 2918 %% This BibTeX bibliography file was created using BibDesk.
2     %% http://bibdesk.sourceforge.net/
3    
4    
5 chrisfen 2979 %% Created for Chris Fennell at 2006-08-28 10:33:08 -0400
6 chrisfen 2918
7    
8     %% Saved with string encoding Western (ASCII)
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10    
11 chrisfen 2957 @string{acp = {Adv. Chem. Phys.}}
12 chrisfen 2918
13 chrisfen 2957 @string{cp = {Chem. Phys.}}
14 chrisfen 2918
15 chrisfen 2957 @string{cpl = {Chem. Phys. Lett.}}
16 chrisfen 2918
17 chrisfen 2957 @string{jacs = {J. Am. Chem. Soc.}}
18 chrisfen 2918
19 chrisfen 2957 @string{jcc = {J. Comput. Chem.}}
20 chrisfen 2918
21 chrisfen 2957 @string{jcp = {J. Chem. Phys.}}
22 chrisfen 2918
23 chrisfen 2957 @string{jml = {J. Mol. Liq.}}
24 chrisfen 2918
25 chrisfen 2957 @string{jpc = {J. Phys. Chem.}}
26 chrisfen 2918
27 chrisfen 2957 @string{jpca = {J. Phys. Chem. A}}
28 chrisfen 2918
29 chrisfen 2957 @string{jpcb = {J. Phys. Chem. B}}
30 chrisfen 2918
31 chrisfen 2957 @string{mp = {Mol. Phys.}}
32 chrisfen 2918
33 chrisfen 2957 @string{pccp = {Phys. Chem. Chem. Phys.}}
34 chrisfen 2918
35 chrisfen 2957 @string{pnas = {Proc. Natl. Acad. Sci. USA}}
36 chrisfen 2918
37 chrisfen 2957 @string{pra = {Phys. Rev. A}}
38 chrisfen 2918
39 chrisfen 2957 @string{prb = {Phys. Rev. B}}
40 chrisfen 2918
41 chrisfen 2957 @string{pre = {Phys. Rev. E}}
42 chrisfen 2918
43 chrisfen 2957 @string{prl = {Phys. Rev. Lett.}}
44 chrisfen 2918
45 chrisfen 2957 @string{rmp = {Rev. Mod. Phys.}}
46 chrisfen 2918
47    
48 chrisfen 2979 @article{Mezei92,
49     Author = {M. Mezei},
50     Date-Added = {2006-08-28 07:48:49 -0400},
51     Date-Modified = {2006-08-28 07:50:59 -0400},
52     Doi = {10.1002/jcc.540130515},
53     Journal = {J. Comp. Chem.},
54     Number = {5},
55     Pages = {651-656},
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58     Year = {1992}}
59    
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61     Author = {L. Pauling},
62     Date-Added = {2006-08-27 22:01:49 -0400},
63     Date-Modified = {2006-08-27 22:03:59 -0400},
64     Journal = {J. Am. Chem. Soc.},
65     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ResidualEntropy/Pauling_ResidEntropy_33.pdf},
66     Pages = {2680-2684},
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69     Year = {1935}}
70    
71     @article{Nada03,
72     Author = {H. Nada and J.~P.~J.~M. {van der Eerden}},
73     Date-Added = {2006-08-27 21:44:08 -0400},
74     Date-Modified = {2006-08-27 21:47:37 -0400},
75     Doi = {10.1063/1.1562610},
76     Journal = {J. Chem. Phys.},
77     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/Research/Water_Models/Nada_6siteH2O_03.pdf},
78     Number = {16},
79     Pages = {7401-7413},
80     Title = {An intermolecular potential model for the simulation of ice and water near the melting point: \uppercase{A} six-site model of \uppercase{H}$_2$\uppercase{O}},
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82     Year = {2003}}
83    
84 chrisfen 2978 @article{Kindt96,
85     Author = {J.~T. Kindt and C.~A. Schmuttenmaer},
86     Date-Added = {2006-08-27 13:55:26 -0400},
87     Date-Modified = {2006-08-27 13:56:35 -0400},
88     Journal = {J. Phys. Chem.},
89     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ExperimentalWater/Kindt_FarIRDielectricOfPolarLiquids_96.pdf},
90     Number = {24},
91     Pages = {10373-10379},
92     Title = {Far-Infrared Dielectric Properties of Polar Liquids Probed by Femtosecond Terahertz Pulse Spectroscopy},
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95    
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98     Date-Added = {2006-08-24 16:11:43 -0400},
99     Date-Modified = {2006-08-24 16:14:03 -0400},
100     Doi = {10.1016/j.str.2005.11.014},
101     Journal = {Structure},
102     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/2006/Freddolino_VirusSimulation_06.pdf},
103     Pages = {437-449},
104     Title = {Molecular Dynamics Simulations of the Complete Satellite Tobacco Mosaic Virus},
105     Volume = {14},
106     Year = {2006}}
107    
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109     Author = {K.~T. Gillen and D.~C. Douglas and M.~J.~R. Hoch},
110     Date-Added = {2006-08-24 10:40:48 -0400},
111     Date-Modified = {2006-08-24 10:41:10 -0400},
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121     Date-Added = {2006-08-24 10:35:25 -0400},
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131     Journal = {Physica},
132     Pages = {167-178},
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140     Date-Added = {2006-08-24 10:33:59 -0400},
141     Date-Modified = {2006-08-24 10:33:59 -0400},
142     Publisher = {Oxford University Press},
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144     Year = 1969}
145    
146     @article{Mills73,
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148     Date-Added = {2006-08-24 10:24:33 -0400},
149     Date-Modified = {2006-08-24 10:25:04 -0400},
150     Journal = jpc,
151     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ExperimentalWater/Mills_Diffuse_73.pdf},
152     Number = 5,
153     Pages = {685-688},
154     Title = {Self-Diffusion in Normal and Heavy Water in the Range 1-45$^\circ$},
155     Volume = 77,
156     Year = 1973}
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162     Journal = {Compt. Rend. Acad. Sc. Paris},
163     Pages = {4643-4645},
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170     Date-Added = {2006-08-24 10:21:10 -0400},
171     Date-Modified = {2006-08-24 10:22:49 -0400},
172     Journal = jcp,
173     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ExperimentalWater/Badyal_ElectronDistributionInH2O_00.pdf},
174     Number = 21,
175     Pages = {9206-9208},
176     Title = {Electron distribution in water},
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183     Date-Modified = {2006-08-24 10:18:37 -0400},
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193     Date-Added = {2006-08-24 10:10:41 -0400},
194     Date-Modified = {2006-08-24 10:17:06 -0400},
195     Journal = jcp,
196     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/WaterSimulation/Sprik_HBondingAndStaticDielectricInH2O_91.pdf},
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199     Title = {Hydrogen bonding and the static dielectric constant in liquid water},
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206     Date-Modified = {2006-08-24 10:08:37 -0400},
207     Journal = jcp,
208     Number = 19,
209     Pages = {8892-8897},
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216     Date-Added = {2006-08-24 10:03:48 -0400},
217     Date-Modified = {2006-08-24 10:09:05 -0400},
218     Journal = jcp,
219     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/Research/Ice_Simulations/Rahman_ProtonDistributionInIce_72.pdf},
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224     Year = 1972}
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229     Date-Modified = {2006-08-24 09:59:43 -0400},
230     Journal = {J. Chem. Phys.},
231     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/OldPapers/Bernal_TheoryOfWater_33.pdf},
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255     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/MyPapers/Fennell_PairwiseSummationMethods_06.pdf},
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342     Journal = {J. Chem. Phys.},
343     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/WaterSimulation/Laasonen_AbInitioLiquidWater_93.pdf},
344     Number = {11},
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355     Journal = {Proc. Natl. Acad. Sci. USA},
356     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/2006/Donchev_QuantumWater_06.pdf},
357     Number = {23},
358     Pages = {8613-8617},
359     Title = {Water properties from first principles: \uppercase{S}imulations by a general-purpose quantum mechanical polarizable force field},
360     Volume = {103},
361     Year = {2006}}
362    
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366     Date-Modified = {2006-08-02 13:16:04 -0400},
367     Journal = {J. Res. Natl. Bur. Stand.},
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372     Year = {1956}}
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375     Author = {M. Neumann and O. Steinhauser},
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380     Pages = {437-454},
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384    
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386     Author = {M. Neumann},
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389     Journal = {Mol. Phys.},
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399     Date-Modified = {2006-08-02 13:17:29 -0400},
400     Journal = {J. Chem. Eng. Data},
401     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ExperimentalWater/Kell_CompressibilityAndExpansivityOfH2O_75.pdf},
402     Number = {1},
403     Pages = {91-105},
404     Title = {Density, Thermal Expansivity, and Compressibility of Liquid Water from 0$^\circ$ to 150$^\circ$\uppercase{C}: \uppercase{C}orrelations and Tables for Atmospheric Pressure and Saturation Reviewed and Expressed on 1968 Temperature Scale},
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410     Date-Added = {2006-08-01 16:02:31 -0400},
411     Date-Modified = {2006-08-02 13:16:50 -0400},
412     Journal = {J. Phys. Chem. Ref. Data},
413     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ExperimentalWater/Wagner_ThermodynamicPropertiesOfH2O_03.pdf},
414     Number = {2},
415     Pages = {387-535},
416     Title = {The \uppercase{IAPWS} Formulation 1995 for the Thermodynamic Properties of Ordinary Water Substance for General and Scientific Use},
417     Volume = {31},
418     Year = {2002}}
419    
420     @article{Neumann84,
421     Author = {M. Neumann and O. Steinhauser and G.~S. Pawley},
422     Date-Added = {2006-07-31 10:22:39 -0400},
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424     Journal = {Mol. Phys.},
425     Number = {1},
426     Pages = {97-113},
427     Title = {Consistent calculation of the static and frequency-dependent dielectric constant in computer simulations},
428     Volume = {52},
429     Year = {1984}}
430    
431     @article{Neumann85,
432     Author = {M. Neumann},
433     Date-Added = {2006-07-31 10:19:17 -0400},
434     Date-Modified = {2006-08-02 13:17:58 -0400},
435     Journal = {J. Chem. Phys.},
436     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/DielectricConst./Neumann_H2ODielConst_85.pdf},
437     Number = {12},
438     Pages = {5663-5672},
439     Title = {The dielectric constant of water. \uppercase{C}omputer simulations with the \uppercase{MCY} potential},
440     Volume = {82},
441     Year = {1985}}
442    
443     @book{Berry00,
444     Address = {New York},
445     Author = {R. Stephen Berry and Stuart A. Rice and John Ross},
446     Date-Added = {2006-07-30 14:49:40 -0400},
447     Date-Modified = {2006-07-30 14:53:08 -0400},
448     Edition = {Second},
449     Editor = {Donald G. Truhlar},
450     Publisher = {Oxford University Press, Inc.},
451     Series = {Topics in Physical Chemistry},
452     Title = {Physical Chemistry},
453     Year = {2000}}
454    
455 chrisfen 2957 @article{Sorenson00,
456     Author = {J.~M. Sorenson and G. Hura and R.~M. Glaeser and T. Head-Gordon},
457     Date-Added = {2006-07-21 11:41:31 -0400},
458     Date-Modified = {2006-07-21 11:44:44 -0400},
459     Journal = {J. Chem. Phys.},
460     Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/ExperimentalWater/THGord_X-RayRadial_2000.pdf},
461     Number = {20},
462     Pages = {9149-9161},
463     Title = {What can x-ray scattering tell us about the radial distribution functions of water?},
464     Volume = {113},
465     Year = {2000}}
466    
467     @book{CRC80,
468     Address = {Boca Raton, FL},
469     Date-Added = {2006-07-21 09:20:17 -0400},
470     Date-Modified = {2006-07-21 09:20:17 -0400},
471     Edition = 60,
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