A theoretical interpretation of the bonding, and the photoelectron and ultra-violet spectra of sulphur dioxide
- 1 January 1971
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 22 (2), 193-201
- https://doi.org/10.1080/00268977100102471
Abstract
Ab initio SCFMO calculations are described for SO2, using Slater-type orbitals expanded in gaussian-type functions. The electronic structures of SO, O3 and O2 are investigated, to facilitate analysis of the nature of sulphur 3d orbital participation in SO2. The theoretical interpretation of the photoelectron and ultra-violet spectra of SO2 is considered.Keywords
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