ISSN:
0020-7608
Keywords:
Computational Chemistry and Molecular Modeling
;
Atomic, Molecular and Optical Physics
Source:
Wiley InterScience Backfile Collection 1832-2000
Topics:
Chemistry and Pharmacology
Notes:
In the framework of the Heitler-London method, a method for determining the allowed molecular multiplets is proposed. The method is based on the connection of the total molecular spin with the permutation symmetry of the coordinate wave function and on the isomorphism of the molecular point group with a certain subgroup of the electron permutation group. The method does not depend on the approximation in which the molecular ions are considered.
Additional Material:
2 Tab.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1002/qua.560080204