A theoretical study of the spectroscopy of HOBr and its deuterated isotopomer is presented. Highly accurate ab initio potential energy and dipole moment surfaces have been determined at the multireference configuration interaction level of theory, with large triple-~" quality basis sets. From the an
Ionic adsorption and the surface dipole potential
β Scribed by Wolfgang Schmickler; Rolando Guidelli
- Publisher
- Elsevier Science
- Year
- 1987
- Weight
- 356 KB
- Volume
- 235
- Category
- Article
- ISSN
- 0022-0728
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