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Ab Initio Approach to the Structure, Vibrational Properties, and Electron Binding Energies of H(2)S∙∙∙SO(2)
The present study employs high-level ab initio calculations to investigate the structure, vibrational frequencies, and electronic properties of H(2)S∙∙∙SO(2). The analysis of vibrational frequencies reveals an intramolecular vibrational energy transfer phenomenon, where energy from the stretching mo...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
MDPI
2023
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10535889/ https://www.ncbi.nlm.nih.gov/pubmed/37764431 http://dx.doi.org/10.3390/molecules28186656 |