Electronic Resource
New York, NY
:
Wiley-Blackwell
International Journal of Quantum Chemistry
8 (1974), S. 423-426
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:
A general formalism in order to deal with SCF eigenspace manipulation is developed. It can be shown that the initial generalized secular equation splits into a set of secular equations, each of which in turn can modify independently any predetermined subset of the SCF manifold.
Type of Medium:
Electronic Resource
URL:
http://dx.doi.org/10.1002/qua.560080308
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