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Predicting DFT band gaps from crystal structure
Predict the PBE band gap of a crystal in eV from its structure, over 106,113 Materials Project entries.
PR
PR 把工作从一条路线带到另一条；合并它就是采纳。
新建 PR
Predict the PBE band gap of a crystal in eV from its structure, over 106,113 Materials Project entries.
PR 把工作从一条路线带到另一条；合并它就是采纳。