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Chemical Potentials by Monte Carlo Simulations Model
written by
Fernando Silva Fernandes
The Chemical Potentials by Monte Carlo Simulations Model performs canonical (NVT) and isothermal-isobaric (NPT) Monte Carlo simulations focusing the calculation of chemical potentials, for the fluid phases of the Lennard-Jones system, by using the virtual particle insertion method of Widom. Although it can not determine phase-equilibrium directly, the gas-liquid line can be approached as illustrated in the included case study. The model paves the way to uVT and Gibbs Ensemble simulations, and shows the limitation of Widom's method at high fluid densities.
The Chemical Potentials by Monte Carlo Simulations Model was developed using the Easy Java Simulations (EJS) modeling tool. It is distributed as a ready-to-run (compiled) Java archive. Double clicking the jar file will run the program if Java is installed. You can modify this simulation if you have EJS installed by right-clicking within the map and selecting "Open Ejs Model" from the pop-up menu item. Please note that this resource requires at least version 1.6 of Java (JRE).
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Record Link
<a href="https://www.compadre.org/portal/items/detail.cfm?ID=13035">Fernandes, Fernando Silva. "Chemical Potentials by Monte Carlo Simulations Model."</a>
AIP Format
F. Fernandes, Computer Program CHEMICAL POTENTIALS BY MONTE CARLO SIMULATIONS MODEL (2013), WWW Document, (https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605).
AJP/PRST-PER
F. Fernandes, Computer Program CHEMICAL POTENTIALS BY MONTE CARLO SIMULATIONS MODEL (2013), <https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605>.
APA Format
Fernandes, F. (2013). Chemical Potentials by Monte Carlo Simulations Model [Computer software]. Retrieved March 22, 2025, from https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605
Chicago Format
Fernandes, Fernando Silva. "Chemical Potentials by Monte Carlo Simulations Model." https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605 (accessed 22 March 2025).
MLA Format
Fernandes, Fernando Silva. Chemical Potentials by Monte Carlo Simulations Model. Computer software. 2013. Java (JRE) 1.6. 22 Mar. 2025 <https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605>.
BibTeX Export Format
@misc{
Author = "Fernando Silva Fernandes",
Title = {Chemical Potentials by Monte Carlo Simulations Model},
Month = {October},
Year = {2013}
}
Refer Export Format
%A Fernando Silva Fernandes %T Chemical Potentials by Monte Carlo Simulations Model %D October 30, 2013 %U https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605 %O application/java
EndNote Export Format
%0 Computer Program %A Fernandes, Fernando Silva %D October 30, 2013 %T Chemical Potentials by Monte Carlo Simulations Model %8 October 30, 2013 %U https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13035&DocID=3605 Disclaimer: ComPADRE offers citation styles as a guide only. We cannot offer interpretations about citations as this is an automated procedure. Please refer to the style manuals in the Citation Source Information area for clarifications.
Citation Source Information
The AIP Style presented is based on information from the AIP Style Manual. The APA Style presented is based on information from APA Style.org: Electronic References. The Chicago Style presented is based on information from Examples of Chicago-Style Documentation. The MLA Style presented is based on information from the MLA FAQ. Chemical Potentials by Monte Carlo Simulations Model:
Is Based On
Easy Java Simulations Modeling and Authoring Tool
The Easy Java Simulations Modeling and Authoring Tool is needed to explore the computational model used in the Chemical Potentials by Monte Carlo Simulations Model. relation by Wolfgang ChristianKnow of another related resource? Login to relate this resource to it. |
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