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@article{Aguado03, |
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Author = {A. Aguado and P.~A. Madden}, |
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Date-Added = {2013-07-10 15:18:11 +0000}, |
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Date-Modified = {2013-07-10 15:18:11 +0000}, |
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Doi = {10.1063/1.1605941}, |
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Journal = {J. Chem. Phys.}, |
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Number = {14}, |
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Pages = {7471-7483}, |
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Title = {Ewald summation of electrostatic multipole interactions up to the quadrupolar level}, |
| 21 |
Volume = {119}, |
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Year = {2003}, |
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Bdsk-Url-1 = {http://dx.doi.org/10.1063/1.1605941}} |
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@article{deLeeuw80, |
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Author = {S.~W. {de Leeuw} and J.~W. Perram and E.~R. Smith}, |
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Date-Added = {2013-07-10 15:18:02 +0000}, |
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Date-Modified = {2013-07-10 15:18:02 +0000}, |
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Journal = {Proc. R. Soc. London Ser. A}, |
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Number = {1752}, |
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Pages = {27-56}, |
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Title = {Simulation of Electostatic Systems in Periodic Boundary Conditions. \uppercase{I. L}attice Sums and Dielectric Constants}, |
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Volume = {373}, |
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Year = {1980}} |
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@article{Smith81, |
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Author = {E.~R. Smith}, |
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Date-Added = {2013-07-10 15:18:02 +0000}, |
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Date-Modified = {2013-07-10 15:18:02 +0000}, |
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Journal = {Proc. R. Soc. London Ser. A}, |
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Pages = {475-505}, |
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Title = {Electrostatic Energy in Ionic Crystals}, |
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Volume = {375}, |
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Year = {1981}} |
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@article{Smith82, |
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Author = {W. Smith}, |
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Date-Added = {2013-07-10 15:18:02 +0000}, |
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Date-Modified = {2013-07-10 15:24:21 +0000}, |
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Journal = {CCP5 Information quarterly}, |
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Pages = {13-25}, |
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Title = {Point multipoles in the \uppercase{E}wald summation}, |
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Volume = 4, |
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Year = 1982} |
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@article{Smith96, |
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Author = {W. Smith and T. Forester}, |
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Date-Added = {2013-07-10 15:18:02 +0000}, |
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Date-Modified = {2013-07-10 15:18:02 +0000}, |
| 60 |
Journal = {J. Molec. Graphics.}, |
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Number = 3, |
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Pages = {136-141}, |
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Title = {\uppercase{DL\_POLY\_2.0: A} general-purpose parallel molecular dynamics simulation package}, |
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Volume = 14, |
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Year = 1996} |
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@article{Smith98, |
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Author = {W. Smith}, |
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Date-Added = {2013-07-10 15:18:02 +0000}, |
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Date-Modified = {2013-07-10 15:18:02 +0000}, |
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Journal = {CCP5 Information Quarterly}, |
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Pages = {18-30}, |
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Title = {Point multipoles in the \uppercase{E}wald summation (Revisited)}, |
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Volume = {46}, |
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Year = {1998}} |
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@article{Meineke05, |
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Author = {M.~A. Meineke and C.~F. {Vardeman II} and T. Lin and C.~J. Fennell and J.~D. Gezelter}, |
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Date-Added = {2013-07-10 15:17:35 +0000}, |
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Date-Modified = {2013-07-10 15:17:35 +0000}, |
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Journal = {J. Comp. Chem.}, |
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Pages = {252-271}, |
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Title = {$\mbox{OOPSE: A}$n Open Source Object-Oriented Parallel Simulation Engine for Molecular Dynamics}, |
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Volume = 26, |
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Year = 2005} |
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@article{Fennell06, |
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Author = {C.~J. Fennell and J.~D. Gezelter}, |
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Date-Added = {2013-07-10 15:17:31 +0000}, |
| 90 |
Date-Modified = {2013-07-10 15:17:31 +0000}, |
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Doi = {10.1063/1.2206581}, |
| 92 |
Journal = {J. Chem. Phys.}, |
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Number = {23}, |
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Pages = {234104(12)}, |
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Rating = {5}, |
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Read = {Yes}, |
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Title = {Is the \uppercase{E}wald summation still necessary? \uppercase{P}airwise alternatives to the accepted standard for long-range electrostatics}, |
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Volume = {124}, |
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Year = {2006}, |
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Bdsk-Url-1 = {http://dx.doi.org/10.1063/1.2206581}} |
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@article{Wolf99, |
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Author = {D. Wolf and P. Keblinski and S.~R. Phillpot and J. Eggebrecht}, |
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Date-Added = {2013-07-10 15:17:24 +0000}, |
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Date-Modified = {2013-07-10 15:17:24 +0000}, |
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Journal = {J. Chem. Phys.}, |
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Number = {17}, |
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Pages = {8254-8282}, |
| 109 |
Rating = {0}, |
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Read = {No}, |
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Title = {Exact method for the simulation of Coulombic systems by spherically truncated, pairwise $r^{-1}$ summation}, |
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Volume = {110}, |
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Year = {1999}} |
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@article{Zahn02, |
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Author = {D. Zahn and B. Schilling and S.~M. Kast}, |
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Date-Added = {2013-07-10 15:17:24 +0000}, |
| 118 |
Date-Modified = {2013-07-10 15:17:24 +0000}, |
| 119 |
Journal = {J. Phys. Chem. B}, |
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Number = {41}, |
| 121 |
Pages = {10725-10732}, |
| 122 |
Title = {Enhancement of the \uppercase{W}olf Damped Coulomb Potential: $\mbox{S}$tatic, Dynamic, and Dielectric Properties of Liquid Water from Molecular Simulation}, |
| 123 |
Volume = {106}, |
| 124 |
Year = {2002}} |
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@article{Ma05, |
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Author = {Y. Ma and S.~H. Garofalini}, |
| 128 |
Date-Added = {2013-07-10 15:17:24 +0000}, |
| 129 |
Date-Modified = {2013-07-10 15:17:24 +0000}, |
| 130 |
Journal = {Mol. Simul.}, |
| 131 |
Number = 11, |
| 132 |
Pages = {739-748}, |
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Title = {Modified Wolf electrostatic summation: Incorporating an empirical charge overlap}, |
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Volume = 31, |
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Year = 2005} |
