LAMMPS 22Jul2025-foss-2024a-kokkos

LAMMPS is a classical molecular dynamics code, and an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator.

Accessing LAMMPS 22Jul2025-foss-2024a-kokkos

To load the module for LAMMPS 22Jul2025-foss-2024a-kokkos please use this command on the BEAR systems (BlueBEAR and BEAR Cloud VMs):

📋 module load bear-apps/2024a
module load LAMMPS/22Jul2025-foss-2024a-kokkos

BEAR Apps Version

2024a

Architectures

EL8-emeraldrapids — EL8-icelake — EL8-sapphirerapids

The listed architectures consist of two parts: OS-CPU. The OS used is represented by EL and there are several different processor (CPU) types available on BlueBEAR. More information about the processor types on BlueBEAR is available on the BlueBEAR Job Submission page.

More Information

For more information visit the LAMMPS website.

Dependencies

This version of LAMMPS has a direct dependency on: cURL/8.7.1-GCCcore-13.3.0 Eigen/3.4.0-GCCcore-13.3.0 FFmpeg/7.0.2-GCCcore-13.3.0 foss/2024a GSL/2.8-GCC-13.3.0 gzip/1.13-GCCcore-13.3.0 HDF5/1.14.5-gompi-2024a kim-api/2.4.1-GCC-13.3.0 libjpeg-turbo/3.0.1-GCCcore-13.3.0 libpng/1.6.43-GCCcore-13.3.0 libxml2/2.12.7-GCCcore-13.3.0 MDI/1.4.26-gompi-2024a mpi4py/4.0.1-gompi-2024a netCDF/4.9.2-gompi-2024a PCRE/8.45-GCCcore-13.3.0 PLUMED/2.9.3-foss-2024a Python/3.12.3-GCCcore-13.3.0 ScaFaCoS/1.0.4-foss-2024a SciPy-bundle/2024.05-gfbf-2024a tbb/2021.13.0-GCCcore-13.3.0 Voro++/0.4.6-GCCcore-13.3.0 VTK/9.3.1-foss-2024a zlib/1.3.1-GCCcore-13.3.0

Other Versions

These versions of LAMMPS are available on the BEAR systems (BlueBEAR and BEAR Cloud VMs). These will be retained in accordance with our Applications Support and Retention Policy.

Last modified on 25th November 2025