/tools/jarvis

jarvis

usnistgov/jarvis

368 stars136 forksPythonWebsiteAdded February 5, 2026
summary

JARVIS-Tools is an open-source software package designed for data-driven atomistic materials design. It provides capabilities for setting up calculations, analysis, and informatics, as well as database and web-page development.

description

About JARVIS-Tools: an open-source software package for data-driven atomistic materials design. Publications: https://scholar.google.com/citations?user=3w6ej94AAAAJ https://www.youtube.com/@dr_k_choudhary

topics

dftmdvasplammpsscikit-learntensorflowpytorchatomistic-simulationsmaterials-informaticsmgiaiquantum-computing

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