ATK-ForceField: a new generation molecular dynamics software package
Volume: 25, Issue: 8, Pages: 085007 - 085007
Published: Oct 30, 2017
Abstract
ATK-ForceField is a software package for atomistic simulations using classical interatomic potentials. It is implemented as a part of the Atomistix ToolKit (ATK), which is a Python programming environment that makes it easy to create and analyze both standard and highly customized simulations. This paper will focus on the atomic interaction potentials, molecular dynamics, and geometry optimization features of the software, however, many more...
Paper Details
Title
ATK-ForceField: a new generation molecular dynamics software package
Published Date
Oct 30, 2017
Volume
25
Issue
8
Pages
085007 - 085007
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