VLE Simulator

By Julian C Umeh1; Thomas A Manz1

1. New Mexico State University

Simulates the vapor liquid equilibrium of the first five Alkanes

Launch Tool

You must login before you can run this tool.

Version 1.5 - published on 29 Aug 2022

doi:10.21981/YEED-W741 cite this

Open source: license | download

View All Supporting Documents

    Sample Input File

Category

Tools

Published on

Abstract

This tool simulates the vapor liquid equilibrium (VLE) of  alkanes namely; methane, ethane, propane, butane and pentane. It calculates gas and liquid densities as well as coexistence pressure.

Powered by

RASPA

Sponsored by

National Science Foundation (NSF)

Publications

Julian Umeh, Development of Simulation Tools on Nanohub as Learning Modules, Master Thesis, New Mexico State University, Las Cruces, New Mexico, December 2019. Major professor: Thomas Manz.

Cite this work

Researchers should cite this work as follows:

  • Julian C Umeh, Thomas A Manz (2022), "VLE Simulator," https://nanohub.org/resources/vle. (DOI: 10.21981/YEED-W741).

    BibTex | EndNote

Tags

  1. chemistry
  2. computational chemistry
  3. force fields
  4. Monte Carlo
  5. RASPA
  6. vapor-liquid equilibrium
  7. VLE