LAMMPS

Description

LAMMPS is a classical molecular dynamics code, and an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. LAMMPS has potentials for solid-state materials (metals, semiconductors) and soft matter (biomolecules, polymers) and coarse-grained or mesoscopic systems. It can be used to model atoms or, more generically, as a parallel particle simulator at the atomic, meso, or continuum scale. LAMMPS runs on single processors or in parallel using message-passing techniques and a spatial-decomposition of the simulation domain. The code is designed to be easy to modify or extend with new functionality.

More information

  • Homepage: https://www.lammps.org

Availability

Module

Generic

E5

Lake

Epyc

Cascade

LAMMPS/23Jun2022-foss-2021b-kokkos-CUDA-11.4.1

LAMMPS/23Jun2022-foss-2021b-kokkos