Supplementary Data for 'Multireference and Coupled Cluster Study of Dimethyltetroxide (MeO4Me) Formation and Decomposition'

Name: Supplementary Data for 'Multireference and Coupled Cluster Study of Dimethyltetroxide (MeO4Me) Formation and Decomposition'
Creator: University of Copenhagen; University of Helsinki
Published: 2024-02-28T00:00:00+08:00

Zenodo2024-02-28 更新2026-04-07 收录

四氧化物反应机理

量子化学基准计算

数据链接：

https://zenodo.org/doi/10.5281/zenodo.10277012 数据链接链接失效反馈

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资源简介：

This dataset contains supplementary data for the publication 'High-level Benchmark of Tetroxide Formation and its Decomposition'. Data consists of various output-files of quantum chemical computations.

提供机构：

University of Copenhagen; University of Helsinki

创建时间：

2024-02-28