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Proceedings Paper

The study of liquid water structure and transfer properties by molecular dynamics
Author(s): Vasily Vl. Mitrofanov
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Paper Abstract

In this work, by means of molecular dynamics we continue our research devoted to study of liquid water structure and transfer properties. The system under study is a "water drop" consisting of 1000 water molecules. By using SPC, TIP3P, TIP4P and TIP5P models for water a temperature dependence of selfdiffusion of liquid water is investigated. By means of radial distribution functions analysis an investigation of liquid water structure is performed for SPC, TIP3P, TIP4P and TIP5P models for water. The results obtained are compared with experiment.

Paper Details

Date Published: 26 April 2007
PDF: 10 pages
Proc. SPIE 6535, Saratov Fall Meeting 2006: Optical Technologies in Biophysics and Medicine VIII, 65351T (26 April 2007); doi: 10.1117/12.741009
Show Author Affiliations
Vasily Vl. Mitrofanov, Moscow State Univ. (Russia)


Published in SPIE Proceedings Vol. 6535:
Saratov Fall Meeting 2006: Optical Technologies in Biophysics and Medicine VIII

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