Data for "Thermal Desorption Kinetics, Binding Energies, and Entrapment of Methyl Mercaptan Ices"
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This data includes infrared and mass spectra for thermal desorption experiments of methyl mercaptan and methanol ices. There are also Gaussian 16 log files that were used for complementary analysis of the data (i.e. single and dimer molecule optimization+frequency calculations) using the M062X/cc-pVDZ or M062X/cc-pVQZ level of theory.
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Zenodo创建时间：
2024-10-22
