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A theoretical study of triatomic carbon-silicon mixed clusters. Relative energies and binding energies

โœ Scribed by P.W. Deutsch; L.A. Curtiss

Publisher
Elsevier Science
Year
1994
Tongue
English
Weight
387 KB
Volume
226
Category
Article
ISSN
0009-2614

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โœฆ Synopsis

The Gaussian-2 (G2) theoretical procedure, based on ab initio molecular orbital theory, is used to calculate the energies of mixed triatomic clusters of carbon and silicon. The G2 energies are used to derive accurate binding energies which are compared with experimental values.

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