Molecular Modeling of Hydrogen Bonding Fluids: Monomethylamine, Dimethylamine, and Water Revised

DOI10.1007/978-3-540-36183-1_37zbMATH Open1388.92042OpenAlexW2255356442MaRDI QIDQ4643555FDOQ4643555

Authors: Thorsten Schnabel, Jadran Vrabec, Hans Hasse 

Publication date: 24 May 2018

Published in: High Performance Computing in Science and Engineering ’06 (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/978-3-540-36183-1_37

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zbMATH Keywords

thermophysical propertieshydrogen bonding fluids

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Cites Work

• Fast parallel algorithms for short-range molecular dynamics
• High Performance Computing in Engineering and Science

Cited In (1)

• Theoretical prediction of thermal diffusion in water-methanol, water-ethanol, and water-isopropanol mixtures using the PC-SAFT equation of state

Uses Software

• GAMESS

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