quacc
Publicquacc is a flexible platform for computational materials science and quantum chemistry that is built for the big data era.
chemistrycomputational-materials-sciencedatabasedfthigh-throughputhpcpythonquantum-chemistryquantum-mechanicsworkflow
Creat:2021-12-19T04:57:31
Update:2025-03-26T01:18:07
https://quantum-accelerators.github.io/quacc/
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