Vapor-Liquid Equilibria in Five-Site (TIP5P) Models of Water

Result code in IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F67985858%3A_____%2F04%3A00340734" target="_blank" >RIV/67985858:_____/04:00340734 - isvavai.cz</a>

Result on the web

—

DOI - Digital Object Identifier

—

Result language

angličtina

Original language name

Vapor-Liquid Equilibria in Five-Site (TIP5P) Models of Water

Original language description

Using the Gibbs ensemble Monte Carlo simulations, vapor-liquid equilibria in a new, reparametrized five-site model (TIP5P-E) of water have been determined and compared with the original TIP5P model of Mahoney and Jorgensen and TIP4P water. It is shown that for vapor-liquid equilibria properties the new model provides only a marginal improvement over the original model and both models are considerably inferior to the TIP4P model.

Czech name

—

Czech description

—

Type

J_x - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

CEP classification

CF - Physical chemistry and theoretical chemistry

OECD FORD branch

—

Project

Result was created during the realization of more than one project. More information in the Projects tab.

Continuities

P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>Z - Vyzkumny zamer (s odkazem do CEZ)

Publication year

2004

Confidentiality

S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Name of the periodical

Journal of Physical Chemistry B

ISSN

1520-6106

e-ISSN

—

Volume of the periodical

108

Issue of the periodical within the volume

22

Country of publishing house

US - UNITED STATES

Number of pages

3

Pages from-to

—

UT code for WoS article

000221700300069

EID of the result in the Scopus database

—