Quantum-Chemical Bonding Database (Unprocessed data : Part 5)
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资源简介:
This dataset is published as part of our publication: A Quantum-Chemical Bonding Database for Solid-State Materials Refer to mpids.txt to see data related to which compounds are available in the tar file. (mp-xxx refer to Materials Project ID)
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Zenodo创建时间:
2023-04-23



