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Esca studies of Ga, As, GaAs, Ga2O3, As2O3 and As2O5

✍ Scribed by Yusuke Mizokawa; Hiroshi Iwasaki; Ryusuke Nishitani; Shogo Nakamura

Publisher
Elsevier Science
Year
1978
Tongue
English
Weight
961 KB
Volume
14
Category
Article
ISSN
0368-2048

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We computed the optimized geometries and energy separations of several electronic states of GaaAs 2 and Ga2As 3 clusters using the complete active space multiconfiguration self-consistent-field (CASSCF) followed by multireference singles + doubles configuration interaction (MRSDCI) computations whic