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Open‐source Molecular Modeling Software in Chemical Engineering Focusing on the Molecular Simulation Design Framework

Peter T. Cummings,Clare McCabe,Christopher R. Iacovella,Akos Ledeczi,Eric Jankowski,Arthi Jayaraman,Jeremy C. Palmer,Edward J. Maginn,Sharon C. Glotzer,Joshua A. Anderson,J. Ilja Siepmann,Jeffrey Potoff,Ray A. Matsumoto,Justin B. Gilmer,Ryan S. DeFever,Ramanish Singh,Brad Crawford

AICHE JOURNAL（2021）

引用 7|浏览3
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关键词
adsorption/gas,computer simulations (MC and MD),simulation,molecular,thermodynamics/statistical
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