Description
Open Knowledgebase of Interatomic Models.KIM is an API and OpenKIM is a collection of interatomic models (potentials) foratomistic simulations. This is a library that can be used by simulation programsto get access to the models in the OpenKIM database.This EasyBuild only installs the API, the models can be installed with thepackage openkim-models, or the user can install them manually by runningkim-api-collections-management install user MODELNAMEorkim-api-collections-management install user OpenKIMto install them all.
More information
- Homepage: https://openkim.org/
Available Versions of kim-api
Version | Module | Available on |
|---|---|---|
2.3.0-GCCcore-11.3.0 | chem/kim-api/2.3.0-GCCcore-11.3.0 | Noctua 1, Noctua 2 |
2.3.0-GCCcore-11.2.0 | chem/kim-api/2.3.0-GCCcore-11.2.0 | Noctua 1, Noctua 2 |
2.3.0-foss-2022a | chem/kim-api/2.3.0-foss-2022a | Noctua 2 |
2.2.1-GCCcore-10.3.0 | chem/kim-api/2.2.1-GCCcore-10.3.0 | Noctua 2 |
2.1.3-foss-2020a | chem/kim-api/2.1.3-foss-2020a | Noctua 2 |
2.1.3-foss-2019b | chem/kim-api/2.1.3-foss-2019b | Noctua 2 |
This table is generated automatically. If you need other versions please click pc2-support@uni-paderborn.de.
Usage Hints for kim-api
If you need support in using this software or example job scipts please contact pc2-support@uni-paderborn.de.