Official websites use .gov
A .gov website belongs to an official government organization in the United States.
Secure .gov websites use HTTPS
A lock (
) or https:// means you’ve safely connected to the .gov website. Share sensitive information only on official, secure websites.
Benchmark Results for Mixtures of TraPPE Molecules
The purpose of these pages is to provide some explicit results from Monte Carlo simulations for mixtures of TraPPE molecules [1,2]. It is intended to provide guides for testing codes. Reproducing these results is a test of the correctness of codes, either written by the user or obtained elsewhere. The explicit conditions for each of the sets of results are supplied so that meaningful comparisons of your results with the ones listed here are possible.
The information presented here has been organized into several different pages.
- EOS-TMMC: Properties of Binary Mixtures of TraPPE Carbon Dioxide and TraPPE Nitrogen
- TMMC: Reference Adsorption Isotherms for N2/CO2 Mixtures in Metal-organic Frameworks