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X-ray photoelectron spectra and electronic structure of Bi2X3 (X = O, S, Se, Te)

✍ Scribed by Thomas P. Debies; J.Wayne Rabalais


Publisher
Elsevier Science
Year
1977
Tongue
English
Weight
693 KB
Volume
20
Category
Article
ISSN
0301-0104

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The electronic structure of X3, X = O, S
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The electronic and geometrical structural properties of the group VIA trimers, Os, S,, Se3 and Tel in their ground and lowestenergy anion states have been calculated using an ab initio complete active space (CAS) MCSCF method with a double-zeta+polarization Gaussian basis set. Compact effective pote