five

1D scan and reactant region geometries for Fig. 2, 3 and 4

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下载链接:
https://zenodo.org/record/5576085
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资源简介:
Raw data for the ManyHF paper (under preparation as "ManyHF: A Pragmatic Automated Method of Finding Lower Energy Hartree-Fock Solutions for Potential Energy Surface Development")
创建时间:
2021-11-03
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