Automated Interactive Infrastructure and Database
AiiDA is an open-source Python infrastructure for managing and tracking complex computational workflows — built for reproducibility, scale, and the long tail of "what did I run six months ago?"
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Repositories
Showing 10 of 82 repositories
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- acwf-verification-scripts Public
Scripts to run and perform data analysis on the AiiDA common workflows (ACWF) subproject on verification
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- aiida-wannier90-workflows Public
A collection of advanced automated workflows to compute Wannier functions using AiiDA and the Wannier90 code
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- staged-recipes Public Forked from conda-forge/staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
