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Calculation of excitation energies of open-shell molecules with spatially degenerate ground states. I. Transformed reference via an intermediate configuration Kohn-Sham density-functional theory and applications to d[sup 1] and d[sup 2] systems with octahedral and tetrahedral symmetries

✍ Scribed by Seth, Michael; Ziegler, Tom


Book ID
125439272
Publisher
American Institute of Physics
Year
2005
Tongue
English
Weight
338 KB
Volume
123
Category
Article
ISSN
0021-9606

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