ISSN:
0020-7608
Schlagwort(e):
Computational Chemistry and Molecular Modeling
;
Atomic, Molecular and Optical Physics
Quelle:
Wiley InterScience Backfile Collection 1832-2000
Thema:
Chemie und Pharmazie
Notizen:
The equilibrium distances of the complex components and the stabilization energies were calculated for the molecular complexes ethylene-fluorine, ethylene-chlorine, tetracyanoethylene-benzene, tetracyanoethylene-durene, and quinone-hydroquinone using the PCILO method. The results are compared with the experimental values and the theoretical predictions of the CNDO/2 method.
Zusätzliches Material:
4 Ill.
Materialart:
Digitale Medien
URL:
http://dx.doi.org/10.1002/qua.560110306
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