Supplemental for Benchmarking the quadrupolar coupling tensor for chlorine to probe weak-bonding interactions
收藏GRO.data2022-01-01 更新2026-04-17 收录
下载链接：
https://data.goettingen-research-online.de/citation?persistentId=doi:10.25625/VMY3WD
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资源简介：
Output files of all calculations for the publication 'Benchmarking the quadrupolar coupling tensor for chlorine to probe weak-bonding interactions' Contains raw output files, data table and custom basis set for Orca.
创建时间：
2022-01-01
