LONG-RANGE STRUCTURES IN BULK WATER - A MOLECULAR-DYNAMICS STUDY

Citation
A. Kohlmeyer et al., LONG-RANGE STRUCTURES IN BULK WATER - A MOLECULAR-DYNAMICS STUDY, Zeitschrift fur Naturforschung. A, A journal of physical sciences, 52(5), 1997, pp. 432-434
Citations number
16
Categorie Soggetti
Chemistry Physical",Physics
ISSN journal
09320784
Volume
52
Issue
5
Year of publication
1997
Pages
432 - 434
Database
ISI
SICI code
0932-0784(1997)52:5<432:LSIBW->2.0.ZU;2-A
Abstract
We present recent calculations of pair correlation functions and parti al structure factors derived from molecular dynamics simulations of la rge bulk water systems (up to 12167 water molecules). We observe small amplitude oscillations of the pair correlation functions in the range between 10 and 20 Angstrom.