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kim-query

Community

Helper routines for querying the OpenKIM database hosted at https://query.openkim.org

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::kim-query

Usage Tracking

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Description

The Open Knowledgebase of Interatomic Models (OpenKIM) project is a framework designed to facilitate access to standardized implementations of empirical interatomic potentials ("Models") and simulation codes that use them to compute material properties ("Tests"). Models and Tests archived at openkim.org are automatically run together to generate the predictions of the models for a host of material properties. These predictions are inserted into a public database hosted at query.openkim.org; this package provides python convenience routines for querying this database.

About

Summary

Helper routines for querying the OpenKIM database hosted at https://query.openkim.org

Last Updated

Jan 27, 2025 at 17:08

License

CDDL-1.0

Total Downloads

18.3K

Supported Platforms

noarch