Direct theoretical ab initio calculations in exchange coupled copper(II) dimers: Influence of the choice of the atomic basis set on the singlet–triplet splitting in modeled and real copper dimers
de Loth, Philippe, Daudey, Jean-Pierre, Astheimer, Harald, Walz, Leonhard, Haase, WolfgangVolume:
82
Year:
1985
Language:
english
Journal:
The Journal of Chemical Physics
DOI:
10.1063/1.448626
File:
PDF, 596 KB
english, 1985