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Replication Data for: Formation of highly oxygenated organic molecules from the oxidation of limonene by OH radical: significant contribution of H-abstraction pathway

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DataCite Commons2023-07-10 更新2024-07-13 收录
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https://data.fz-juelich.de/citation?persistentId=doi:10.26165/JUELICH-DATA/9JVHEK
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资源简介:
Quantum chemical data used for the theoretical kinetic data, including geometries and vibrational wavenumbers at the M06-2X-D3/aug-cc-pVTZ level of theory, and energies at methodologies up to CCSD(T)/aug-cc-pVTZ
提供机构:
Jülich DATA
创建时间:
2023-07-10
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