LAMMPS driver tool for potential calibration

By Saaketh Desai1; Alejandro Strachan1

1. Purdue University

Calculates basic properties of interest with a given interatomic potential and is used to drive the calibration of the potential.

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Version 1.0 - published on 24 Feb 2019

doi:10.21981/9XQ9-K306 cite this

Open source: license | download

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Usage

World usage

Location of all "LAMMPS driver tool for potential calibration" Users Since Its Posting

Cumulative Simulation Users

82

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Simulation Runs

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Overview
Average Total
Wall Clock Time 1.7 hours 10.84 days
CPU time 5.32 seconds 13.57 minutes
Interaction Time 37.23 minutes 3.96 days