Home > Publications database > Replication Data for: Effect of the alkoxy radical chemistry on the ozone formation from anthropogenic organic compounds investigated in chamber experiments |
Dataset | FZJ-2024-05906 |
2024
Jülich DATA
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Please use a persistent id in citations: doi:10.26165/JUELICH-DATA/J2LHTQ
Abstract: Quantum chemical data used for the theoretical kinetic data, including geometries and vibrational wavenumbers at the M06-2X-D3/aug-cc-pVTZ levels of theor, and energies at methodologies up to CCSD(T)/aug-cc-pVTZ
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