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USTC-KnowledgeComputingLab
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qmb-models

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qmb-models / ya_N2_cc_pvdz_PES_14_56

Commit History

Update the format of FCIDUMP ref energy to yaml.

479173e
verified

hzhangxyz commited on Apr 9, 2025

Add N2 PES data.

7538a3b
verified

hzhangxyz commited on Mar 13, 2025