OpenKIM

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1. kliff kliff Public

   KIM-based Learning-Integrated Fitting Framework for interatomic potentials.

   Python 40 21

2. kim-api kim-api Public

   The Open Knowledgebase of Interatomic Models (OpenKIM) aims to be an online resource for standardized testing, long-term warehousing and easy retrieval of interatomic models and data.

   C++ 38 20

3. kimpy kimpy Public

   Python interface to the KIM API. See https://openkim.org/kim-api for more information about the KIM API.

   C++ 16 5

4. libdescriptor libdescriptor Public

   Auto-differentiated descriptors using Enzyme

   C++ 12

5. kim-edn kim-edn Public

   KIM-EDN encoder and decoder

   Python 5

6. kim-property kim-property Public

   KIM-PROPERTY utility module

   Python 5 3