Modified force decomposition algorithms for calculating three-body interactions via molecular dynamics

Author:

Li Jianhui,Zhou Zhongwu,Sadus Richard J.

Publisher

Elsevier BV

Subject

General Physics and Astronomy,Hardware and Architecture

Reference23 articles.

1. Computer Simulation in Chemical Physics;Allen,1993

2. Molecular Simulation of Fluids: Theory, Algorithms and Object-Orientation;Sadus,1999

3. Interaction of van der Waals type between three atoms;Axilrod;J. Chem. Phys.,1943

4. Fast parallel algorithms for short-range molecular dynamics;Plimpton;J. Comput. Phys.,1995

5. Many-body effects in intermolecular forces;Elrod;Chem. Rev.,1994

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3. A Load-Balancing Force Decomposition Scheme for Parallel Simulation of Chemical Dynamics with Multiple Inter-atomic Force Models;2013 IEEE 16th International Conference on Computational Science and Engineering;2013-12

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