B3LYP/Def2-TZVPP, GD3BJ, TS chair trifluoromethyl( cis G = -1788.243777) => chair CF3, trans alt pi-face, G = -1788.237819

Name: B3LYP/Def2-TZVPP, GD3BJ, TS chair trifluoromethyl( cis G = -1788.243777) => chair CF3, trans alt pi-face, G = -1788.237819
Creator: Imperial College London
Published: 2024-05-26 10:40:25
License: 暂无描述

DataCite Commons2024-05-26 更新2025-04-16 收录

下载链接：

https://data.hpc.imperial.ac.uk/resolve/?doi=13864

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资源简介：

Gaussian 16 (C01) calculation

Gaussian 16（C01）计算

提供机构：

Imperial College London

创建时间：

2024-02-21

B3LYP/Def2-TZVPP, GD3BJ, TS chair trifluoromethyl( cis G = -1788.243777) =&gt; chair CF3, trans alt pi-face, G = -1788.237819

B3LYP/Def2-TZVPP, GD3BJ, TS chair trifluoromethyl( cis G = -1788.243777) => chair CF3, trans alt pi-face, G = -1788.237819