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Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model
written by Fernando Silva Fernandes
The Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model compares canonical molecular dynamics and Monte Carlo versus microcanonical Creutz's demon simulations. The molecules interact in 3D through Lennard-Jones's potential and a wide range of densities, temperatures and energies can be simulated. The Monte Carlo computations sample the configuration and velocity spaces similarly to molecular dynamics. Thermodynamic properties, radial, speed and demon distribution functions are displayed allowing to assess the consistency between the ensembles and methods implemented. .

The Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon 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 1.7 of Java (JRE).
1 source code document is available
Subjects Levels Resource Types
Other Sciences
- Chemistry
Thermo & Stat Mech
- Ensembles
= Maxwell Velocity Distribution
- General
- Models
= Ideal Gas
= Lennard-Jones Potential
- Phase Transitions
- Upper Undergraduate
- Graduate/Professional
- Instructional Material
= Model
= Simulation
Intended Users Formats Ratings
- Educators
- Researchers
- application/java
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Access Rights:
Free access
License:
This material is released under a GNU General Public License Version 3 license.
Rights Holder:
Fernando M.S. Silva Fernandes
Record Cloner:
Metadata instance created September 16, 2014 by Wolfgang Christian
Record Updated:
September 16, 2014 by Wolfgang Christian
Last Update
when Cataloged:
September 16, 2014
Other Collections:

ComPADRE is beta testing Citation Styles!

Record Link
AIP Format
F. Fernandes, Computer Program MOLECULAR DYNAMICS, METROPOLIS MONTE CARLO AND CREUTZ'S DEMON MODEL (2014), WWW Document, (https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915).
AJP/PRST-PER
F. Fernandes, Computer Program MOLECULAR DYNAMICS, METROPOLIS MONTE CARLO AND CREUTZ'S DEMON MODEL (2014), <https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915>.
APA Format
Fernandes, F. (2014). Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model [Computer software]. Retrieved August 7, 2020, from https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915
Chicago Format
Fernandes, Fernando Silva. "Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model." https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915 (accessed 7 August 2020).
MLA Format
Fernandes, Fernando Silva. Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model. Computer software. 2014. Java (JRE) 1.7. 7 Aug. 2020 <https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915>.
BibTeX Export Format
@misc{ Author = "Fernando Silva Fernandes", Title = {Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model}, Month = {September}, Year = {2014} }
Refer Export Format

%A Fernando Silva Fernandes
%T Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model
%D September 16, 2014
%U https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915
%O application/java

EndNote Export Format

%0 Computer Program
%A Fernandes, Fernando Silva
%D September 16, 2014
%T Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon Model
%8 September 16, 2014
%U https://www.compadre.org/Repository/document/ServeFile.cfm?ID=13344&DocID=3915


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.

Molecular Dynamics, Metropolis Monte Carlo and Creutz's Demon 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 Metropolis Monte Carlo and Creutz's Demon MD Model.

relation by Wolfgang Christian

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