kim-api 2.2.1-GCCcore-10.2.0

Open Knowledgebase of Interatomic Models. KIM is an API and OpenKIM is a collection of interatomic models (potentials) for atomistic simulations. This is a library that can be used by simulation programs to get access to the models in the OpenKIM database. This EasyBuild only installs the API, the models can be installed with the package openkim-models, or the user can install them manually by running kim-api-collections-management install user MODELNAME or kim-api-collections-management install user OpenKIM to install them all.

Accessing kim-api 2.2.1-GCCcore-10.2.0

To load the module for kim-api 2.2.1-GCCcore-10.2.0 please use this command on Baskerville:

📋 module load bask-apps/test
module load kim-api/2.2.1-GCCcore-10.2.0

Bask Apps Env

test

More Information

For more information visit the kim-api website.

Dependencies

This version of kim-api has a direct dependency on: CMake/3.18.4-GCCcore-10.2.0 GCCcore/10.2.0

Required By

This version of kim-api is a direct dependent of: LAMMPS/29Oct2020-fosscuda-2020b-kokkos

Last modified on 12th November 2021