Effects of translational and rotational degrees of freedom on the properties of model water

Molecular dynamics simulations with separate thermostats for rotational and translational motions were used to study the effects of these degrees of freedom on the structure of water at a fixed density. To describe water molecules, we used the SPC/E model. The results indicate that an increase of th...

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Datum:2015
Hauptverfasser: Mohorič, T., Hribar-Lee, B., Vlachy, V.
Format: Artikel
Sprache:English
Veröffentlicht: Інститут фізики конденсованих систем НАН України 2015
Schriftenreihe:Condensed Matter Physics
Online Zugang:http://dspace.nbuv.gov.ua/handle/123456789/153525
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Назва журналу:Digital Library of Periodicals of National Academy of Sciences of Ukraine
Zitieren:Effects of translational and rotational degrees of freedom on the properties of model water / T. Mohorič, T. Mohorič, V. Vlachy // Condensed Matter Physics. — 2015. — Т. 18, № 1. — С. 13004: 1–9. — Бібліогр.: 13 назв. — англ.

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