TS, C-O cleavage, no boron + 2 extra water, TZVPP, G = -1321.741657 (Reactants = -1,321.804102), ΔG = 39.7 IRC

Name: TS, C-O cleavage, no boron + 2 extra water, TZVPP, G = -1321.741657 (Reactants = -1,321.804102), ΔG = 39.7 IRC
Creator: Imperial College London
Published: 2025-03-13 07:00:39
License: 暂无描述

DataCite Commons2025-03-13 更新2025-04-16 收录

下载链接：

https://data.hpc.imperial.ac.uk/resolve/?doi=15005

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资源简介：

Gaussian 16 (C01) calculation

高斯16（Gaussian 16，C01）计算

提供机构：

Imperial College London

创建时间：

2025-02-26