deepmodeling / DeePTB

DeePTB: A deep learning package for tight-binding approach with ab initio accuracy.
GNU Lesser General Public License v3.0
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Update: Organize e3, add e3 statistics in LMDB dataset and add e3 fitting of overlap #183

Closed floatingCatty closed 5 months ago

QG-phy commented 5 months ago

我审完了,没问题。