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Comparison of the TIP4P-2005, SWM4-DP and BK3 interaction potentials of liquid water with respect to their consistency with neutron and X-ray diffraction data of pure water

Following a fairly comprehensive study on popular interaction potentials of water (Pusztai et al 2008, J. Chem. Phys., 129, 184103), here two more recent, polarizable potential sets, SWM4-DP (Lamoureux et al., Chem. Phys. Lett., 2006, 418, 245) and BK3 (Kiss et al. J. Chem. Phys., 2013, 138, 204507)...

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Veröffentlicht in:	Condensed Matter Physics
Datum:	2013
Hauptverfasser:	Steinczinger, Z., Pusztai, L.
Format:	Artikel
Sprache:	Englisch
Veröffentlicht:	Інститут фізики конденсованих систем НАН України 2013
Online Zugang:	https://nasplib.isofts.kiev.ua/handle/123456789/120855
Tags:	Tag hinzufügen Keine Tags, Fügen Sie den ersten Tag hinzu!
Назва журналу:	Digital Library of Periodicals of National Academy of Sciences of Ukraine
Zitieren:	Comparison of the TIP4P-2005, SWM4-DP and BK3 interaction potentials of liquid water with respect to their consistency with neutron and X-ray diffraction data of pure water / Z. Steinczinger, L. Pusztai // Condensed Matter Physics. — 2013. — Т. 16, № 4. — С. 43604:1-8. — Бібліогр.: 24 назв. — англ.

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Digital Library of Periodicals of National Academy of Sciences of Ukraine

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