Ecosyste.ms: Packages

An open API service providing package, version and dependency metadata of many open source software ecosystems and registries.

pypi.org "interatomic potential" keyword

Top 9.9% on pypi.org
potentials 0.3.8
API database tools for accessing the NIST Interatomic Potentials Repository: explore and download...
21 versions - Latest release: about 1 month ago - 2 dependent packages - 3 dependent repositories - 7.13 thousand downloads last month - 10 stars on GitHub - 1 maintainer
Top 5.4% on pypi.org
matgl 1.1.1
MatGL is a framework for graph deep learning for materials science.
28 versions - Latest release: 20 days ago - 9 dependent packages - 2 dependent repositories - 23.3 thousand downloads last month - 215 stars on GitHub - 1 maintainer
m3gnet 0.2.4
Materials Graph with Three-body Interactions
16 versions - Latest release: over 1 year ago - 5 dependent packages - 1 dependent repositories - 807 downloads last month - 208 stars on GitHub - 2 maintainers
matcalc 0.0.4
Calculators for materials properties from the potential energy surface.
4 versions - Latest release: 5 months ago - 2 dependent packages - 1 dependent repositories - 1.69 thousand downloads last month - 41 stars on GitHub - 1 maintainer
matbench-discovery 1.1.1 💰
A benchmark for machine learning energy models on inorganic crystal stability prediction from unr...
6 versions - Latest release: 4 months ago - 48 downloads last month - 70 stars on GitHub - 1 maintainer
iprpy 0.11.7
Interatomic Potential Repository Python Property Calculations and Tools
12 versions - Latest release: 21 days ago - 1 dependent repositories - 175 downloads last month - 20 stars on GitHub - 1 maintainer