\(\renewcommand{\AA}{\text{Å}}\)

pair_style extep command

Syntax

pair_style extep

Examples

pair_style extep
pair_coeff * * BN.extep B N

Description

Style extep computes the Extended Tersoff Potential (ExTeP) interactions as described in (Los2017).

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Restrictions

none

Related commands

pair_tersoff <pair tersoff>

Default

none

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(Los2017) J. H. Los et al. “Extended Tersoff potential for boron nitride: Energetics and elastic properties of pristine and defective h-BN”, Phys. Rev. B 96 (184108), 2017.