trunk/multipole/dielectric_new.bib

%% This BibTeX bibliography file was created using BibDesk.
%% http://bibdesk.sourceforge.net/


%% Created for Dan Gezelter at 2016-05-11 11:37:48 -0400 


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@string{cpl = {Chem. Phys. Lett.}}

@string{jcp = {J. Chem. Phys.}}

@string{jctc = {J. Chem. Theory Comput.}}

@string{jpcb = {J. Phys. Chem. B}}

@string{jpcc = {J. Phys. Chem. C}}

@string{mp = {Mol. Phys.}}


@article{Stenqvist:2015ph,
        Author = {Stenqvist, Bj{\"o}rn and Trulsson, Martin and Abrikosov, Alexei I. and Lund, Mikael},
        Date-Added = {2016-04-14 18:22:12 +0000},
        Date-Modified = {2016-05-11 15:37:40 +0000},
        Journal = {J. Chem. Phys.},
        Number = {1},
        Title = {Direct summation of dipole-dipole interactions using the Wolf formalism},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/143/1/10.1063/1.4923001},
        Volume = {143},
        Year = {2015},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/143/1/10.1063/1.4923001},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4923001}}

@book{Raab:2004ve,
        Author = {Raab, R.E. and de Lange, O.L.},
        Date-Added = {2016-04-12 14:09:31 +0000},
        Date-Modified = {2016-04-12 17:44:01 +0000},
        Isbn = {9780198567271},
        Lccn = {2005297163},
        Publisher = {OUP Oxford},
        Series = {International Series of Monographs on Physics},
        Title = {Multipole Theory in Electromagnetism: Classical, quantum, and symmetry aspects, with applications},
        Url = {https://books.google.com/books?id=V4lO6gBY6SgC},
        Year = {2004},
        Bdsk-Url-1 = {https://books.google.com/books?id=V4lO6gBY6SgC}}

@book{Stone:1997ly,
        Author = {Stone, A.J.},
        Date-Added = {2016-04-10 13:53:00 +0000},
        Date-Modified = {2016-04-10 13:53:00 +0000},
        Isbn = {9780198558835},
        Lccn = {96008025},
        Publisher = {Clarendon Press},
        Series = {International Series of Monographs on Chemistry},
        Title = {The Theory of Intermolecular Forces},
        Url = {https://books.google.com/books?id=nQvhXDVnmowC},
        Year = {1997},
        Bdsk-Url-1 = {https://books.google.com/books?id=nQvhXDVnmowC}}

@book{Morse:1946zr,
        Author = {Morse, P.M.C. and Feshbach, H.},
        Date-Added = {2016-04-10 13:46:34 +0000},
        Date-Modified = {2016-04-12 17:45:34 +0000},
        Publisher = {Technology Press},
        Title = {{Methods of Theoretical Physics}},
        Url = {https://books.google.com/books?id=CSxWAAAAMAAJ},
        Year = {1946},
        Bdsk-Url-1 = {https://books.google.com/books?id=CSxWAAAAMAAJ}}

@book{Morse:1953ys,
        Author = {Morse, P.M.C. and Feshbach, H.},
        Date-Added = {2016-04-10 13:45:24 +0000},
        Date-Modified = {2016-04-10 13:45:24 +0000},
        Lccn = {52011515},
        Number = {v. 2},
        Publisher = {McGraw-Hill},
        Series = {International series in pure and applied physics},
        Title = {Methods of theoretical physics},
        Url = {https://books.google.com/books?id=DvZQAAAAMAAJ},
        Year = {1953},
        Bdsk-Url-1 = {https://books.google.com/books?id=DvZQAAAAMAAJ}}

@article{Wu:2005nr,
        Author = {Wu, Xiongwu and Brooks, Bernard R.},
        Date-Added = {2016-03-28 18:06:59 +0000},
        Date-Modified = {2016-04-08 17:40:06 +0000},
        Eid = 044107,
        Journal = {J. Chem. Phys.},
        Number = {4},
        Title = {Isotropic periodic sum: A method for the calculation of long-range interactions},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/122/4/10.1063/1.1836733},
        Volume = {122},
        Year = {2005},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/122/4/10.1063/1.1836733},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1836733}}

@article{Wang:2016kx,
        Author = {Wang, Han and Nakamura, Haruki and Fukuda, Ikuo},
        Date-Added = {2016-03-28 18:03:52 +0000},
        Date-Modified = {2016-04-08 17:40:30 +0000},
        Eid = 114503,
        Journal = {J. Chem. Phys.},
        Number = {11},
        Title = {A critical appraisal of the zero-multipole method: Structural, thermodynamic, dielectric, and dynamical properties of a water system},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/144/11/10.1063/1.4943956},
        Volume = {144},
        Year = {2016},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/144/11/10.1063/1.4943956},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4943956}}

@article{Fukuda:2013uq,
        Author = {Fukuda, Ikuo},
        Date-Added = {2016-03-28 18:03:23 +0000},
        Date-Modified = {2016-04-08 17:40:21 +0000},
        Eid = 174107,
        Journal = {J. Chem. Phys.},
        Number = {17},
        Title = {Zero-multipole summation method for efficiently estimating electrostatic interactions in molecular system},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/139/17/10.1063/1.4827055},
        Volume = {139},
        Year = {2013},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/139/17/10.1063/1.4827055},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4827055}}

@article{Meineke05,
        Author = {M.~A. Meineke and C.~F. {Vardeman II} and T. Lin and C.~J. Fennell and J.~D. Gezelter},
        Date-Added = {2016-03-28 15:39:34 +0000},
        Date-Modified = {2016-03-28 15:39:34 +0000},
        Journal = {J. Comp. Chem.},
        Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/MyPapers/Meineke_OOPSE_05.pdf},
        Pages = {252-271},
        Title = {OOPSE: An Open Source Object-Oriented Parallel Simulation Engine for Molecular Dynamics},
        Volume = 26,
        Year = 2005}

@book{openmd,
        Author = {J. Daniel Gezelter and Madan Lamichhane and Joseph Michalka and Patrick Louden and Kelsey M. Stocker and Shenyu Kuang and James Marr and Chunlei Li and Charles F. Vardeman and Teng Lin and Christopher J. Fennell and Xiuquan Sun and Kyle Daily and Yang Zheng and Matthew A. Meineke},
        Date-Added = {2016-03-28 15:39:28 +0000},
        Date-Modified = {2016-04-08 20:52:20 +0000},
        Publisher = {An open source molecular dynamics engine},
        Title = {OpenMD},
        Url = {http://openmd.org (accessed 4/8/2016)},
        Year = {version 2.4, {\tt http://openmd.org} (accessed 4/8/2016)},
        Bdsk-Url-1 = {http://openmd.org%20(accessed%2011/13/2013)}}

@article{Smith82,
        Author = {W. Smith},
        Date-Added = {2016-03-28 15:39:22 +0000},
        Date-Modified = {2016-04-08 17:47:57 +0000},
        Journal = {CCP5 Information Quarterly},
        Pages = {13-25},
        Title = {Point multipoles in the \uppercase{E}wald summation},
        Volume = 4,
        Year = 1982}

@article{Smith98,
        Author = {W. Smith},
        Date-Added = {2016-03-28 15:39:22 +0000},
        Date-Modified = {2016-03-28 15:39:22 +0000},
        Journal = {CCP5 Information Quarterly},
        Pages = {18-30},
        Title = {Point multipoles in the \uppercase{E}wald summation (Revisited)},
        Volume = {46},
        Year = {1998}}

@article{Fixman:1974fk,
        Abstract = {A classical system of mass points subject to holonomic constraints has a kinetic energy dependent on the coordinates as well as the moments of the remaining degrees of freedom. Coordinate averages formed in the reduced space of unconstrained coordinates and their conjugate momenta then involve a metric determinant that may be difficult to evaluate. A theorem is derived that permits a relatively easy evaluation when the constraints are distances between particles, and an application is made to a Kramers type freely jointed chain.},
        Author = {Fixman, Marshall},
        Date-Added = {2016-03-28 14:03:50 +0000},
        Date-Modified = {2016-04-08 17:47:34 +0000},
        Journal = {Proc. Natl. Acad. Sci. USA},
        Number = {8},
        Pages = {3050-3053},
        Title = {Classical Statistical Mechanics of Constraints: A Theorem and Application to Polymers},
        Url = {http://www.pnas.org/content/71/8/3050.abstract},
        Volume = {71},
        Year = {1974},
        Bdsk-Url-1 = {http://www.pnas.org/content/71/8/3050.abstract}}

@article{Wolf99,
        Author = {D. Wolf and P. Keblinski and S.~R. Phillpot and J. Eggebrecht},
        Date-Added = {2013-07-10 15:17:24 +0000},
        Date-Modified = {2013-07-10 15:17:24 +0000},
        Journal = {J. Chem. Phys.},
        Number = {17},
        Pages = {8254-8282},
        Rating = {0},
        Read = {No},
        Title = {Exact method for the simulation of Coulombic systems by spherically truncated, pairwise $r^{-1}$ summation},
        Volume = {110},
        Year = {1999}}

@article{Zahn02,
        Author = {D. Zahn and B. Schilling and S.~M. Kast},
        Date-Added = {2013-07-10 15:17:24 +0000},
        Date-Modified = {2013-07-10 15:17:24 +0000},
        Journal = {J. Phys. Chem. B},
        Number = {41},
        Pages = {10725-10732},
        Title = {Enhancement of the \uppercase{W}olf Damped Coulomb Potential: $\mbox{S}$tatic, Dynamic, and Dielectric Properties of Liquid Water from Molecular Simulation},
        Volume = {106},
        Year = {2002}}

@article{Kast03,
        Author = {S.~M. Kast and K.~F. Schmidt and B. Schilling},
        Date-Added = {2013-12-06 16:42:41 +0000},
        Date-Modified = {2013-12-06 16:42:41 +0000},
        Journal = Cpl,
        Pages = {398-404},
        Title = {Integral Equation Theory for Correcting Truncation Errors in Molecular Simulations},
        Volume = {367},
        Year = {2003}}

@article{Beckd05,
        Affiliation = {Biomolecular Structure and Design Program, University of Washington, Seattle, Washington 98195-7610, And Department of Medicinal Chemistry, University of Washington, Seattle, Washington 98195-7610},
        Author = {Beck, D.A.C. And Armen, R.S. And Daggett, V.},
        Date-Added = {2013-12-06 16:42:41 +0000},
        Date-Modified = {2013-12-06 16:42:41 +0000},
        Issn = {0006-2960},
        Journal = {Biochemistry},
        Number = {2},
        Pages = {609-616},
        Title = {Cutoff Size Need Not Strongly Influence Molecular Dynamics Results for Solvated Polypeptides},
        Url = {Http://Pubs3.Acs.Org/Acs/Journals/Doilookup?In_Doi=10.1021/Bi0486381},
        Volume = {44},
        Year = {2005},
        Bdsk-Url-1 = {Http://Pubs3.Acs.Org/Acs/Journals/Doilookup?In_Doi=10.1021/Bi0486381}}

@article{Ma05,
        Author = {Y. Ma and S.~H. Garofalini},
        Date-Added = {2013-07-10 15:17:24 +0000},
        Date-Modified = {2013-07-10 15:17:24 +0000},
        Journal = {Mol. Simul.},
        Number = 11,
        Pages = {739-748},
        Title = {Modified Wolf electrostatic summation: Incorporating an empirical charge overlap},
        Volume = 31,
        Year = 2005}

@article{Fennell06,
        Author = {C.~J. Fennell and J.~D. Gezelter},
        Date-Added = {2013-07-10 15:17:31 +0000},
        Date-Modified = {2013-07-10 15:17:31 +0000},
        Doi = {10.1063/1.2206581},
        Journal = {J. Chem. Phys.},
        Number = {23},
        Pages = {234104(12)},
        Rating = {5},
        Read = {Yes},
        Title = {Is the \uppercase{E}wald summation still necessary? \uppercase{P}airwise alternatives to the accepted standard for long-range electrostatics},
        Volume = {124},
        Year = {2006},
        Bdsk-Url-1 = {http://dx.doi.org/10.1063/1.2206581}}

@article{PaperII,
        Author = {Lamichhane, Madan and Newman, Kathie E. and Gezelter, J. Daniel},
        Date-Modified = {2016-04-08 17:41:15 +0000},
        Doi = {http://dx.doi.org/10.1063/1.4896628},
        Eid = 134110,
        Journal = {J. Chem. Phys.},
        Number = {13},
        Pages = {-},
        Title = {Real space electrostatics for multipoles. II. Comparisons with the Ewald sum},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/141/13/10.1063/1.4896628},
        Volume = {141},
        Year = {2014},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/141/13/10.1063/1.4896628},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4896628}}

@article{PaperI,
        Author = {Lamichhane, Madan and Gezelter, J. Daniel and Newman, Kathie E.},
        Date-Modified = {2016-04-08 17:41:10 +0000},
        Doi = {http://dx.doi.org/10.1063/1.4896627},
        Eid = 134109,
        Journal = {J. Chem. Phys.},
        Number = {13},
        Pages = {-},
        Title = {Real space electrostatics for multipoles. I. Development of methods},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/141/13/10.1063/1.4896627},
        Volume = {141},
        Year = {2014},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/141/13/10.1063/1.4896627},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4896627}}

@article{Kirkwood39,
        Author = {Kirkwood, John G.},
        Date-Modified = {2016-04-08 17:41:45 +0000},
        Doi = {http://dx.doi.org/10.1063/1.1750343},
        Journal = {J. Chem. Phys.},
        Number = {10},
        Pages = {911-919},
        Title = {The Dielectric Polarization of Polar Liquids},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/7/10/10.1063/1.1750343},
        Volume = {7},
        Year = {1939},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/7/10/10.1063/1.1750343},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1750343}}

@article{Onsagar36,
        Author = {Lars Onsager},
        Date-Modified = {2016-04-08 17:42:10 +0000},
        Doi = {10.1021/ja01299a050},
        Journal = {J. Am. Chem. Soc.},
        Number = {8},
        Pages = {1486-1493},
        Title = {Electric Moments of Molecules in Liquids},
        Volume = {58},
        Year = {1936},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/ja01299a050}}

@book{Allen89,
        Abstract = {{Computer simulation is an essential tool in studying the chemistry and physics of liquids.  Simulations allow us to develop models and to test them against experimental data. They can be used to evaluate approximate theories of liquids, and to provide detailed information on the structure and dynamics of model liquids at the molecular level. This book is an introduction and practical guide to the molecular dynamics and Monte Carlo methods.    The first four chapters describe these methods in detail, and provide the essential background in intermolecular forces and statistical mechanics.  Chapters 5 and 6 emphasize the practical aspects of writing efficient programs and analysing the simulation results.  The remaining chapters cover advanced techniques, non-equilibrium methods, Brownian dynamics, quantum simulations, and some important applications.  FORTRAN code is presented in the text.}},
        Author = {Allen, M. P. and Tildesley, D. J.},
        Citeulike-Article-Id = {1820925},
        Citeulike-Linkout-0 = {http://www.amazon.ca/exec/obidos/redirect?tag=citeulike09-20\&amp;path=ASIN/0198556454},
        Citeulike-Linkout-1 = {http://www.amazon.de/exec/obidos/redirect?tag=citeulike01-21\&amp;path=ASIN/0198556454},
        Citeulike-Linkout-10 = {http://www.worldcat.org/oclc/20281700},
        Citeulike-Linkout-2 = {http://www.amazon.fr/exec/obidos/redirect?tag=citeulike06-21\&amp;path=ASIN/0198556454},
        Citeulike-Linkout-3 = {http://www.amazon.jp/exec/obidos/ASIN/0198556454},
        Citeulike-Linkout-4 = {http://www.amazon.co.uk/exec/obidos/ASIN/0198556454/citeulike00-21},
        Citeulike-Linkout-5 = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/0198556454},
        Citeulike-Linkout-6 = {http://www.worldcat.org/isbn/0198556454},
        Citeulike-Linkout-7 = {http://books.google.com/books?vid=ISBN0198556454},
        Citeulike-Linkout-8 = {http://www.amazon.com/gp/search?keywords=0198556454\&index=books\&linkCode=qs},
        Citeulike-Linkout-9 = {http://www.librarything.com/isbn/0198556454},
        Date-Added = {2014-07-17 17:43:42 +0000},
        Date-Modified = {2014-07-17 17:43:42 +0000},
        Day = {29},
        Edition = {Reprint},
        Howpublished = {Paperback},
        Isbn = {0198556454},
        Keywords = {computer\_simulation\_of\_liquids, dynamics, liquids, molecular, simulations},
        Month = jun,
        Posted-At = {2009-09-21 01:53:35},
        Priority = {2},
        Publisher = {Oxford University Press, USA},
        Series = {Oxford science publications},
        Title = {{Computer Simulation of Liquids}},
        Url = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/0198556454},
        Year = {1989},
        Bdsk-Url-1 = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20%5C&path=ASIN/0198556454}}

@article{NeumannI83,
        Author = {Neumann, Martin},
        Date-Added = {2014-07-17 16:58:07 +0000},
        Date-Modified = {2016-04-08 17:44:03 +0000},
        Doi = {10.1080/00268978300102721},
        Journal = {Mol. Phys.},
        Number = {4},
        Pages = {841-858},
        Title = {Dipole moment fluctuation formulas in computer simulations of polar systems},
        Volume = {50},
        Year = {1983},
        Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/00268978300102721},
        Bdsk-Url-2 = {http://dx.doi.org/10.1080/00268978300102721}}

@article{NeumannII83,
        Author = {M. Neumann and O. Steinhauser},
        Date-Added = {2014-07-17 16:52:21 +0000},
        Date-Modified = {2016-04-08 17:44:14 +0000},
        Doi = {http://dx.doi.org/10.1016/0009-2614(83)80585-5},
        Issn = {0009-2614},
        Journal = {Chem. Phys. Lett.},
        Number = {4--5},
        Pages = {417 - 422},
        Title = {On the calculation of the dielectric constant using the Ewald-Kornfeld tensor},
        Volume = {95},
        Year = {1983},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/0009261483805855},
        Bdsk-Url-2 = {http://dx.doi.org/10.1016/0009-2614(83)80585-5}}

@article{Neumann84,
        Author = {M. Neumann and O. Steinhauser and G.~S. Pawley},
        Date-Added = {2014-09-11 17:58:01 +0000},
        Date-Modified = {2014-09-11 17:58:01 +0000},
        Journal = mp,
        Number = {1},
        Pages = {97-113},
        Title = {Consistent calculation of the static and frequency-dependent dielectric constant in computer simulations},
        Volume = {52},
        Year = {1984}}

@article{Neumann85,
        Author = {M. Neumann},
        Date-Added = {2014-09-11 17:58:01 +0000},
        Date-Modified = {2014-09-11 17:58:01 +0000},
        Journal = jcp,
        Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/DielectricConst./Neumann_H2ODielConst_85.pdf},
        Number = {12},
        Pages = {5663-5672},
        Title = {The dielectric constant of water. \uppercase{C}omputer simulations with the \uppercase{MCY} potential},
        Volume = {82},
        Year = {1985}}

@article{Horn04,
        Author = {H.~W. Horn and W.~C. Swope and J.~W. Pitera and J.~D. Madura and T.~J. Dick and G.~L. Hura and T. Head-Gordon},
        Date-Added = {2014-09-11 17:58:10 +0000},
        Date-Modified = {2014-09-11 17:58:10 +0000},
        Doi = {10.1063/1.1683075},
        Journal = jcp,
        Local-Url = {file://localhost/Users/cfennell/Documents/pdf_files/Research/Water_Models/Horn_TIP4P-Ew_04.pdf},
        Number = {20},
        Pages = {9665-9678},
        Title = {Development of an improved four-site water model for biomolecular simulations: \uppercase{TIP4P-E}w},
        Volume = {120},
        Year = {2004},
        Bdsk-Url-1 = {http://dx.doi.org/10.1063/1.1683075}}

@article{LoganI81,
        Author = {David E. Logan},
        Date-Modified = {2016-04-08 17:46:28 +0000},
        Doi = {10.1080/00268978100103181},
        Journal = {Mol. Phys.},
        Number = {6},
        Pages = {1271-1295},
        Title = {On the dielectric theory of fluids},
        Volume = {44},
        Year = {1981},
        Bdsk-Url-1 = {http://dx.doi.org/10.1080/00268978100103181}}

@article{LoganII82,
        Author = {David E. Logan},
        Date-Modified = {2016-04-08 17:46:41 +0000},
        Doi = {10.1080/00268978200101251},
        Journal = {Mol. Phys.},
        Number = {2},
        Pages = {271-285},
        Title = {On the dielectric theory of fluids},
        Volume = {46},
        Year = {1982},
        Bdsk-Url-1 = {http://dx.doi.org/10.1080/00268978200101251}}

@article{LoganIII82,
        Author = {David E. Logan},
        Date-Modified = {2016-04-08 17:46:52 +0000},
        Doi = {10.1080/00268978200101871},
        Journal = {Mol. Phys.},
        Number = {6},
        Pages = {1155-1194},
        Title = {On the dielectric theory of fluids},
        Volume = {46},
        Year = {1982},
        Bdsk-Url-1 = {http://dx.doi.org/10.1080/00268978200101871}}

@article{Izvekov08,
        Author = {Izvekov, Sergei and Swanson, Jessica M. J. and Voth, Gregory A.},
        Date = {APR 17 2008},
        Date-Added = {2013-12-06 16:42:41 +0000},
        Date-Modified = {2013-12-06 16:42:41 +0000},
        Doi = {DOI 10.1021/jp710339n},
        Journal = jpcb,
        Pages = {4711-4724},
        Publisher = {AMER CHEMICAL SOC},
        Timescited = {0},
        Title = {Coarse-graining in interaction space: A systematic approach for replacing long-range electrostatics with short-range Potentials},
        Volume = {112},
        Year = {2008},
        Bdsk-Url-1 = {http://dx.doi.org/10.1021/jp710339n}}

@article{Ernst92,
        Author = {Ernst, Richard M. and Wu, Lei and Liu, Chu-heng and Nagel, Sidney R. and Neubert, Mary E.},
        Doi = {10.1103/PhysRevB.45.667},
        Issue = {2},
        Journal = {Phys. Rev. B},
        Month = {Jan},
        Numpages = {0},
        Pages = {667--672},
        Publisher = {American Physical Society},
        Title = {Quadrupolar susceptibility of complex fluids},
        Url = {http://link.aps.org/doi/10.1103/PhysRevB.45.667},
        Volume = {45},
        Year = {1992},
        Bdsk-Url-1 = {http://link.aps.org/doi/10.1103/PhysRevB.45.667},
        Bdsk-Url-2 = {http://dx.doi.org/10.1103/PhysRevB.45.667}}

@article{JeonI03,
        Author = {Jeon, Jonggu and Kim, Hyung J.},
        Date-Modified = {2016-04-08 17:44:56 +0000},
        Doi = {http://dx.doi.org/10.1063/1.1605376},
        Journal = {J. Chem. Phys.},
        Number = {16},
        Pages = {8606-8625},
        Title = {A continuum theory of solvation in quadrupolar solvents. I. Formulation},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/119/16/10.1063/1.1605376},
        Volume = {119},
        Year = {2003},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/119/16/10.1063/1.1605376},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1605376}}

@article{JeonII03,
        Author = {Jeon, Jonggu and Kim, Hyung J.},
        Date-Modified = {2016-04-08 17:45:04 +0000},
        Doi = {http://dx.doi.org/10.1063/1.1605377},
        Journal = {J. Chem. Phys.},
        Number = {16},
        Pages = {8626-8635},
        Title = {A continuum theory of solvation in quadrupolar solvents. II. Solvation free energetics, dynamics, and solvatochromism},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/119/16/10.1063/1.1605377},
        Volume = {119},
        Year = {2003},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/119/16/10.1063/1.1605377},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1605377}}

@article{Chitanvis96,
        Author = {Chitanvis, Shirish M.},
        Date-Modified = {2016-04-08 17:42:33 +0000},
        Doi = {http://dx.doi.org/10.1063/1.471615},
        Journal = {J. Chem. Phys.},
        Number = {22},
        Pages = {9065-9074},
        Title = {A continuum solvation theory of quadrupolar fluids},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/104/22/10.1063/1.471615},
        Volume = {104},
        Year = {1996},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/104/22/10.1063/1.471615},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.471615}}

@book{Jackson98,
        Abstract = {{A revision of the defining book covering the physics and classical  mathematics necessary to understand electromagnetic fields in materials  and at surfaces and interfaces. The third edition has been revised to  address the changes in emphasis and applications that have occurred in the past twenty years.  }},
        Author = {Jackson, John D.},
        Citeulike-Article-Id = {486037},
        Citeulike-Linkout-0 = {http://www.amazon.ca/exec/obidos/redirect?tag=citeulike09-20\&amp;path=ASIN/047130932X},
        Citeulike-Linkout-1 = {http://www.amazon.de/exec/obidos/redirect?tag=citeulike01-21\&amp;path=ASIN/047130932X},
        Citeulike-Linkout-2 = {http://www.amazon.fr/exec/obidos/redirect?tag=citeulike06-21\&amp;path=ASIN/047130932X},
        Citeulike-Linkout-3 = {http://www.amazon.jp/exec/obidos/ASIN/047130932X},
        Citeulike-Linkout-4 = {http://www.amazon.co.uk/exec/obidos/ASIN/047130932X/citeulike00-21},
        Citeulike-Linkout-5 = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/047130932X},
        Citeulike-Linkout-6 = {http://www.worldcat.org/isbn/047130932X},
        Citeulike-Linkout-7 = {http://books.google.com/books?vid=ISBN047130932X},
        Citeulike-Linkout-8 = {http://www.amazon.com/gp/search?keywords=047130932X\&index=books\&linkCode=qs},
        Citeulike-Linkout-9 = {http://www.librarything.com/isbn/047130932X},
        Date-Modified = {2016-04-12 17:45:05 +0000},
        Day = {10},
        Edition = {Third},
        Howpublished = {Hardcover},
        Isbn = {047130932X},
        Keywords = {general},
        Month = aug,
        Posted-At = {2009-06-17 19:29:28},
        Priority = {2},
        Publisher = {Wiley},
        Title = {{Classical Electrodynamics}},
        Url = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/047130932X},
        Year = {1998},
        Bdsk-Url-1 = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20%5C&path=ASIN/047130932X}}

@article{AduGyamfi78,
        Author = {D. Adu-Gyamfi},
        Date-Modified = {2016-04-08 17:48:43 +0000},
        Doi = {http://dx.doi.org/10.1016/0378-4371(78)90175-9},
        Issn = {0378-4371},
        Journal = {Physica A},
        Number = {3},
        Pages = {553 - 558},
        Title = {On the electric quadrupole density of an isotropic non-polar fluid},
        Url = {http://www.sciencedirect.com/science/article/pii/0378437178901759},
        Volume = {93},
        Year = {1978},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/0378437178901759},
        Bdsk-Url-2 = {http://dx.doi.org/10.1016/0378-4371(78)90175-9}}

@article{AduGyamfi81,
        Abstract = {We calculate the orientational average of the total electric dipole and quadrupole moments of a polar molecule in a non-uniform electric field and comment on the results. },
        Author = {D. Adu-Gyamfi},
        Date-Modified = {2016-04-08 17:48:52 +0000},
        Doi = {http://dx.doi.org/10.1016/0378-4371(81)90174-6},
        Issn = {0378-4371},
        Journal = {Physica A},
        Number = {1},
        Pages = {205 - 210},
        Title = {On the average moments of a polar molecule in a non-uniform electric field},
        Url = {http://www.sciencedirect.com/science/article/pii/0378437181901746},
        Volume = {108},
        Year = {1981},
        Bdsk-Url-1 = {http://www.sciencedirect.com/science/article/pii/0378437181901746},
        Bdsk-Url-2 = {http://dx.doi.org/10.1016/0378-4371(81)90174-6}}

@article{SalvchovI14,
        Author = {Slavchov, Radomir I. and Ivanov, Tzanko I.},
        Date-Modified = {2016-04-08 17:43:21 +0000},
        Doi = {http://dx.doi.org/10.1063/1.4865878},
        Eid = 074503,
        Journal = {J. Chem. Phys.},
        Number = {7},
        Pages = {-},
        Title = {Quadrupole terms in the Maxwell equations: Born energy, partial molar volume, and entropy of ions},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/140/7/10.1063/1.4865878},
        Volume = {140},
        Year = {2014},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/140/7/10.1063/1.4865878},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4865878}}

@article{SalvchovII14,
        Author = {Slavchov, Radomir I.},
        Date-Modified = {2016-04-08 17:43:27 +0000},
        Doi = {http://dx.doi.org/10.1063/1.4871661},
        Eid = 164510,
        Journal = {J. Chem. Phys.},
        Number = {16},
        Pages = {-},
        Title = {Quadrupole terms in the Maxwell equations: Debye-H{\"u}ckel theory in quadrupolarizable solvent and self-salting-out of electrolytes},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/140/16/10.1063/1.4871661},
        Volume = {140},
        Year = {2014},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/140/16/10.1063/1.4871661},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.4871661}}

@article{Stern03,
        Author = {Stern, Harry A. and Feller, Scott E.},
        Date-Modified = {2016-04-08 17:43:01 +0000},
        Doi = {http://dx.doi.org/10.1063/1.1537244},
        Journal = {J. Chem. Phys.},
        Number = {7},
        Pages = {3401-3412},
        Title = {Calculation of the dielectric permittivity profile for a nonuniform system: Application to a lipid bilayer simulation},
        Url = {http://scitation.aip.org/content/aip/journal/jcp/118/7/10.1063/1.1537244},
        Volume = {118},
        Year = {2003},
        Bdsk-Url-1 = {http://scitation.aip.org/content/aip/journal/jcp/118/7/10.1063/1.1537244},
        Bdsk-Url-2 = {http://dx.doi.org/10.1063/1.1537244}}

@article{Wilfred07,
        Author = {Trzesniak, Daniel and Kunz, Anna-Pitschna E. and van Gunsteren, Wilfred F.},
        Doi = {10.1002/cphc.200600527},
        Issn = {1439-7641},
        Journal = {ChemPhysChem},
        Keywords = {computer chemistry, free-energy calculations, molecular dynamics, potential of mean force},
        Number = {1},
        Pages = {162--169},
        Publisher = {WILEY-VCH Verlag},
        Title = {A Comparison of Methods to Compute the Potential of Mean Force},
        Url = {http://dx.doi.org/10.1002/cphc.200600527},
        Volume = {8},
        Year = {2007},
        Bdsk-Url-1 = {http://dx.doi.org/10.1002/cphc.200600527}}

@misc{openmd2.3,
        Author = {J. Daniel Gezelter and Madan Lamichhane and Patrick Louden and Joseph Michalka and Suzanne Niedhart and Teng Lin and Charles F. Vardeman II and Christopher J. Fennell and Matthew A. Meineke and Shenyu Kuang and Kelsey Stocker and James Marr and Xiuquan Sun and Chunlei Li and Kyle Daily and Yang Zheng},
        Date-Modified = {2016-04-08 20:52:27 +0000},
        Howpublished = {Available at {\tt http://openmd.org}},
        Title = {OPENMD-2.4: Molecular Dynamics in the Open}}

@article{Torres-del-Castillo:2006uo,
        Author = {Torres del Castillo, G. F. and M\'{e}ndez Garrido, A.},
        Date-Added = {2014-09-04 21:29:51 +0000},
        Date-Modified = {2014-09-04 21:29:51 +0000},
        Journal = {Revista Mexicana de F\'{i}sica},
        Number = {6},
        Pages = {501-506},
        Title = {Torques on Quadrupoles},
        Volume = {52},
        Year = {2006}}

@article{Adams81,
        Author = {Adams, D.J. and Adams, E.M.},
        Date-Added = {2014-07-17 16:54:22 +0000},
        Date-Modified = {2016-04-08 17:45:52 +0000},
        Doi = {10.1080/00268978100100701},
        Journal = {Mol. Phys.},
        Number = {4},
        Pages = {907-926},
        Title = {Static dielectric properties of the Stockmayer fluid from computer simulation},
        Volume = {42},
        Year = {1981},
        Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/00268978100100701},
        Bdsk-Url-2 = {http://dx.doi.org/10.1080/00268978100100701}}

@article{Adams80,
        Author = {Adams, D.J.},
        Date-Added = {2014-07-17 16:53:50 +0000},
        Date-Modified = {2016-04-08 17:45:46 +0000},
        Doi = {10.1080/00268978000102261},
        Journal = {Mol. Phys.},
        Number = {5},
        Pages = {1261-1271},
        Title = {Computer simulation of highly polar liquids: The hard sphere plus point dipole potential},
        Volume = {40},
        Year = {1980},
        Bdsk-Url-1 = {http://www.tandfonline.com/doi/abs/10.1080/00268978000102261},
        Bdsk-Url-2 = {http://dx.doi.org/10.1080/00268978000102261}}

@book{Arfkan,
        Abstract = {{This best-selling title provides in one handy volume the essential mathematical tools and techniques used to solve problems in physics. It is a vital addition to the bookshelf of any serious student of physics or research professional in the field. The authors have put considerable effort into revamping this new edition.<br><br>* Updates the leading graduate-level text in mathematical physics<br>* Provides comprehensive coverage of the mathematics necessary for advanced study in physics and engineering<br>* Focuses on problem-solving skills and offers a vast array of exercises <br>* Clearly illustrates and proves mathematical relations<br><br><B>New in the Sixth Edition:</B><br>* Updated content throughout, based on users' feedback  <br>* More advanced sections, including differential forms and the elegant forms of Maxwell's equations<br>* A new chapter on probability and statistics<br>* More elementary sections have been deleted}},
        Author = {Arfken, George B. and Weber, Hans J. and Harris, Frank E.},
        Citeulike-Article-Id = {1816367},
        Citeulike-Linkout-0 = {http://www.amazon.ca/exec/obidos/redirect?tag=citeulike09-20\&amp;path=ASIN/0120598760},
        Citeulike-Linkout-1 = {http://www.amazon.de/exec/obidos/redirect?tag=citeulike01-21\&amp;path=ASIN/0120598760},
        Citeulike-Linkout-2 = {http://www.amazon.fr/exec/obidos/redirect?tag=citeulike06-21\&amp;path=ASIN/0120598760},
        Citeulike-Linkout-3 = {http://www.amazon.jp/exec/obidos/ASIN/0120598760},
        Citeulike-Linkout-4 = {http://www.amazon.co.uk/exec/obidos/ASIN/0120598760/citeulike00-21},
        Citeulike-Linkout-5 = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/0120598760},
        Citeulike-Linkout-6 = {http://www.worldcat.org/isbn/0120598760},
        Citeulike-Linkout-7 = {http://books.google.com/books?vid=ISBN0120598760},
        Citeulike-Linkout-8 = {http://www.amazon.com/gp/search?keywords=0120598760\&index=books\&linkCode=qs},
        Citeulike-Linkout-9 = {http://www.librarything.com/isbn/0120598760},
        Date-Modified = {2016-04-12 17:49:09 +0000},
        Day = {05},
        Edition = {6},
        Howpublished = {Hardcover},
        Isbn = {0120598760},
        Keywords = {mathematical-physics},
        Month = jul,
        Posted-At = {2009-05-18 14:56:01},
        Priority = {2},
        Publisher = {Academic Press},
        Title = {{Mathematical Methods for Physicists}},
        Url = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20\&path=ASIN/0120598760},
        Year = {2005},
        Bdsk-Url-1 = {http://www.amazon.com/exec/obidos/redirect?tag=citeulike07-20%5C&path=ASIN/0120598760}}

@article{Adams76,
        Author = {D. J. Adams and I. R. McDonald},
        Date-Modified = {2016-04-08 17:48:22 +0000},
        Doi = {10.1080/00268977600102351},
        Journal = {Mol. Phys.},
        Number = {4},
        Pages = {931-947},
        Title = {Thermodynamic and dielectric properties of polar lattices},
        Url = {http://dx.doi.org/10.1080/00268977600102351},
        Volume = {32},
        Year = {1976},
        Bdsk-Url-1 = {http://dx.doi.org/10.1080/00268977600102351}}
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