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@string{ss = {Surf. Sci.}} |
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@article{Ewald, |
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Author = {C. J. Fennell and J. D. Gezelter}, |
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Date-Added = {2012-12-14 04:22:33 +0000}, |
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Date-Modified = {2012-12-14 04:23:31 +0000}, |
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Journal = {J. Chem. Phys.}, |
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Keywords = {Ewald and OpenMD}, |
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Month = {June}, |
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Pages = {234104}, |
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Title = {Is the Ewald summation still necessary? Pairwise 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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@article{OOPSE, |
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Author = {Meineke, Matthew A. and Vardeman, Charles F. and Lin, Teng and Fennell, Christopher J. and Gezelter, J. Daniel}, |
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Date-Added = {2012-12-14 04:19:33 +0000}, |
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Date-Modified = {2012-12-14 04:19:40 +0000}, |
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Doi = {10.1002/jcc.20161}, |
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Issn = {1096-987X}, |
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Journal = {Journal of Computational Chemistry}, |
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Keywords = {OOPSE, molecular dynamics}, |
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Number = {3}, |
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Pages = {252--271}, |
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Publisher = {Wiley Subscription Services, Inc., A Wiley Company}, |
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Title = {OOPSE: An object-oriented parallel simulation engine for molecular dynamics}, |
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Url = {http://dx.doi.org/10.1002/jcc.20161}, |
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Volume = {26}, |
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Year = {2005}, |
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Bdsk-Url-1 = {http://dx.doi.org/10.1002/jcc.20161}} |
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@article{Monkhorst:1976, |
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Author = {Monkhorst, Hendrik J. and Pack, James D.}, |
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Date-Added = {2012-12-14 02:25:00 +0000}, |
