DFT log files for closed-shell and open-shell organic molecules
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下载链接:
https://figshare.com/articles/dataset/DFT_log_files_for_closed-shell_and_open-shell_organic_molecules/12158649
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资源简介:
raw Gaussian logfiles (M062X/def2TZVP) for optimization + frequency calculations
创建时间:
2020-07-15



