Direct calculation of non-adiabatic states using non-orthogonal CI. Application to the study of the (ArCO)+ cluster
โ Scribed by P. Archirel
- Publisher
- Elsevier Science
- Year
- 1995
- Tongue
- English
- Weight
- 900 KB
- Volume
- 193
- Category
- Article
- ISSN
- 0301-0104
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
A procedure is outlined for the calculation of molecular static electric polnrizabilities ir! excited singkt 2nd triplet states using the "finite perturbation theory" in conjunction with the CNDO/S CI method. Numerical results for the sound and the three lowest excited singlet and triplet states of
A new method of speciation by differential pulse polarography (DPP) is described. It is focused on non-labile complexes on the DPP time scale. By solving mass-balance equations -which are written for the labile part of a metal-ligand system -free metal, free ligand and non-labile complex concentrati