SUBDIVISION OF PHASE-SPACE FOR ANISOTROPICALLY INTERACTING WATER-MOLECULES

Authors
EPIFANOV SY VIGASIN AA
Citation
Sy. Epifanov et Aa. Vigasin, SUBDIVISION OF PHASE-SPACE FOR ANISOTROPICALLY INTERACTING WATER-MOLECULES, Molecular physics, 90(1), 1997, pp. 101-106
Citations number
18
Categorie Soggetti
Physics, Atomic, Molecular & Chemical
Journal title
Molecular physics → ACNP
ISSN journal
00268976
Volume
90
Issue
1
Year of publication
1997
Pages
101 - 106
Database
ISI
SICI code
0026-8976(1997)90:1<101:SOPFAI>2.0.ZU;2-X
Abstract
An efficient numerical algorithm is employed which enables one to perf orm multidimensional integrations of complicated integrands. Temperatu re dependence of the second virial coefficient for water is reproduced using the Matsuoka-Clementi-Yoshimine intermolecular water-water pote ntial. Metastable states are shown to occupy significant domain in the water dimer phase space.