Monte Carlo Simulations in Various Ensembles.

Result code in IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F67985858%3A_____%2F03%3A27030205" target="_blank" >RIV/67985858:_____/03:27030205 - isvavai.cz</a>

Result on the web

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DOI - Digital Object Identifier

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Result language

angličtina

Original language name

Monte Carlo Simulations in Various Ensembles.

Original language description

A Monte Carlo computer simulation method is presented for directly performing property predictions for fluid systems at fixed total internal energy or enthalpy using a molecular-level system model. The method is applicable to both non-reacting and reacting systems. The approach used for derivation of the method also allows us to derive Monte Carlo computer simulation methods in isobaric and grand-canonical ensembles, and can thus be viewed as general approach for design of new simulation techniques.

Czech name

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Czech description

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Type

D - Article in proceedings

CEP classification

CF - Physical chemistry and theoretical chemistry

OECD FORD branch

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Project

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Continuities

Z - Vyzkumny zamer (s odkazem do CEZ)

Publication year

2003

Confidentiality

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

Article name in the collection

Sborník abstraktů.

ISBN

80-86238-37-7

ISSN

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e-ISSN

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Number of pages

5

Pages from-to

1-5

Publisher name

Ústav fyzikální chemie VŠCHT

Place of publication

Praha

Event location

Brejlov [CZ]

Event date

Sep 12, 2003

Type of event by nationality

EUR - Evropská akce

UT code for WoS article

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