Chapter 1. Molecular Dynamics simulations using atomistic potentials
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Chapter 1. Molecular Dynamics simulations using atomistic potentials

Table of Contents

1. Model Classical Hamiltonians

1. Model Classical Hamiltonians

key word for potential/@name

SW

Stillinger-Weber potentials. Currently available parameters are for Si and SiGe. For generic parameters, see the input file of SiGe.

MEAM

MEAM potentials using cubic splines.Currently available parameters are for Si and Ti. For generic parameters, see the input file of Si.

EAM

EAM potentials using cubic splines.Currently available parameters are for Ni and few other metals. For generic parameters, see the input file of Ni.

Keating

Keating potentials.Currently available parameters are for Si,SiGe and few III-V compounds.

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