M. DynaMix -- a scalable portable parallel MD simulation package for arbitrary molecular mixtures

DOI10.1016/S0010-4655(99)00529-9zbMath1031.81505OpenAlexW1985049473WikidataQ56866501 ScholiaQ56866501MaRDI QIDQ1578110

Alexander P. Lyubartsev, Aatto Laaksonen

Publication date: 7 March 2004

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/s0010-4655(99)00529-9

zbMATH Keywords

parallel algorithmsmolecular dynamicscomputer simulationsstandard Fortran 77

Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08) Molecular physics (81V55)

Related Items (2)

Investigation into stability and interfacial properties of hydrate-aqueous fluid system ⋮ Modelling excess surface energy in dry and wetted calcite systems

Uses Software

• M.DynaMix

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