N-body interatomic potential for molecular dynamics simulations of V-Cr-Nb-Mo-Ta-W system

Published: 29 October 2024| Version 2 | DOI: 10.17632/74g7tdr2vm.2
Contributor:
Andrey Kartamyshev

Description

The supplemetary materials to the article "V. N. Maksimenko, A. G. Lipnitskii, V. N. Saveliev, A. I. Kartamyshev, A. V. Vyazmin, D. O. Poletaev. N-body interatomic potential for molecular dynamics simulations of V-Cr-Nb-Mo-Ta-W system. Computational Materials Science".

Files

Steps to reproduce

1. Install LAMMPS package according to the instructions in installing_lammps.txt file; 2. Run lammps with command 'lmp -in control.inp' from subfolders in the lammps_examples folder.

Categories

Molecular Dynamics, Molybdenum Alloys, Niobium Alloys, Tungsten Alloys, Vanadium Alloys, Tantalum Alloys, Chromium Alloys

Funding

Russian Science Foundation

22-72-10026

Licence