LAMMPS

Software Summary

Mesabi

Default Module:

7Aug19/gnu_openmpi

Other Modules Available:

7Aug19/user-intel-2018, 7Aug19/gnu_openmpi, 28Jun14/intel2015-release-impi-mkl, 30Jul16/intel2016-update3-impi-mkl, 7Mar17/intel2016-update3-impi-mkl, 16Mar18/intel2018-release-impi-mkl, 15May19/intel2018-release-impi-mkl, 3Mar20/gnu-8.2.0-ompi-3.1.6-gpu, 24Dec20/gnu-8.2.0-ompi-3.1.6, 17Feb22/gnu-9.2.0-ompi-4.1.1, 17Feb22/gnu-9.2.0-ompi-4.1.1-cuda-11.2

Last Updated On:

Monday, March 14, 2022

Mesabi K40

Default Module:

7Aug19/gnu_openmpi

Other Modules Available:

Last Updated On:

Monday, March 14, 2022

Mangi

Default Module:

28Jun14

Other Modules Available:

28Jun14/intel2015-release-impi-mkl, 30Jul16/intel2016-update3-impi-mkl, 7Mar17/intel2016-update3-impi-mkl, 16Mar18/intel2018-release-impi-mkl, 15May19/intel2018-release-impi-mkl, 3Mar20/gnu-8.2.0-ompi-3.1.6-gpu, 24Dec20/gnu-8.2.0-ompi-3.1.6, 17Feb22/gnu-9.2.0-ompi-4.1.1, 17Feb22/gnu-9.2.0-ompi-4.1.1-cuda-11.2

Last Updated On:

Monday, March 14, 2022

Mangi v100

Default Module:

28Jun14

Other Modules Available:

Last Updated On:

Monday, March 14, 2022

NICE

Default Module:

Other Versions Available:

Last Updated On:

Monday, March 14, 2022

Support Level:

Secondary Support

Software Access Level:

Open Access

Home Page:

Link

Software Categories:

Material Science

Molecular Modeling and Simulation

Software Description

LAMMPS (Large-scale Atomic/Molecular Massively Parallel Simulator) is a software suite for classical molecular dynamics simulations developed and maintained by Sandia National Labs.

Software Documentation

Software Documentation Tabs

General Linux

To load LAMMPS for use in an interactive Linux environment, use the command:

module load lammps

Instructions for running simulations using LAMMPS can be found in the LAMMPS Users Manual.