Occupation numbers of natural orbitals as a criterion for biradical character. Different kinds of biradicals
Doehnert, Detlef, Koutecky, JaroslavVolume:
102
Language:
english
Journal:
Journal of the American Chemical Society
DOI:
10.1021/ja00526a005
Date:
March, 1980
File:
PDF, 977 KB
english, 1980