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

7

World usage

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

Simulation Users

7

4 4 5 7

Users By Organization Type
Type Users
Educational - University 4 (57.14%)
Unidentified 3 (42.86%)
Users by Country of Residence
Country Users
us UNITED STATES 4 (100%)

Simulation Runs

54

44 47 51 54
Overview
Average Total
Wall Clock Time 26.68 minutes 1.22 days
CPU time 2.79 seconds 3.07 minutes
Interaction Time 11.13 minutes 12.24 hours