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Electronic Decoupling in Ground and Excited States of Asymmetric Biaryls

โœ Scribed by Baumgarten, Martin; Gherghel, Lileta; Friedrich, Jan; Jurczok, Martin; Rettig, Wolfgang


Book ID
127257086
Publisher
American Chemical Society
Year
2000
Tongue
English
Weight
156 KB
Volume
104
Category
Article
ISSN
1089-5639

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MRD CI calculations are presented on the asymmetric dissociation and the bending potentials of the ground and nine excited electronic states of H2S, at excitation energies under 9.0 eV. The results show that some similarities exist between the potentials of the states of H2S and those of HzO, but al