Replication Data for: Unimolecular and water reactions of oxygenated and unsaturated Criegee intermediates under atmospheric conditions
收藏DataCite Commons2022-03-17 更新2024-07-13 收录
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https://data.fz-juelich.de/citation?persistentId=doi:10.26165/JUELICH-DATA/MCZDGS
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资源简介：
Selected quantum chemical data is available on all SCI, transition states and products discussed in this work. This includes geometries, moments of inertia for molecular rotation, vibrational wavenumbers, zero point energies, potential energies at various levels of theory, and T1 diagnostics.
提供机构：
Jülich DATA
创建时间：
2022-03-17
