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Molecular Dynamics Simulation: Elementary MethodsMay 1992
- Author:
- J. M. Haile
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Abstract
From the Publisher:
Presented here is a methodologically-oriented treatment of molecular dynamics fundamentals as they relate to hard spheres and Lennard-Jones atoms. The focus is on ``why'' molecular dynamics works and how it is used to estimate properties. The structure revolves around Aristotle's theory of causation in which a complete explanation for a thing necessarily encompasses four causes: material, formal, efficient and final cause.
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