Koopmans’ theorem and its density-functional-theory analog...

Chemical Physics Letters 2018 / 01 Vol. 691

Koopmans’ theorem and its density-functional-theory analog assessed in evaluation of the red shift of vertical ionization potential upon complexation

Gritsenko, O.V.
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Volume:
691
Language:
english
Journal:
Chemical Physics Letters
DOI:
10.1016/j.cplett.2017.11.019
Date:
January, 2018
File:
PDF, 736 KB
english, 2018
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