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Electronic excitation spectrum of thiophene studied by symmetry-adapted cluster configuration interaction method

โœ Scribed by Wan, Jian; Hada, Masahiko; Ehara, Masahiro; Nakatsuji, Hiroshi


Book ID
121797047
Publisher
American Institute of Physics
Year
2001
Tongue
English
Weight
308 KB
Volume
114
Category
Article
ISSN
0021-9606

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## Abstract The ground state and the excited states of benzene, pyrimidine, and pyrazine have been examined by using the symmetry adapted clusterโ€configuration interaction (SACโ€CI) method. Detailed characterizations and the structures of the absorption peaks in the vacuum ultraviolet (VUV), low ene