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Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals

M . Randić ; Department of Physics, University of Utah, Salt Lake City, Utah 84112
F. E. Harris ; Department of Physics, University of Utah, Salt Lake City, Utah 84112

Puni tekst: engleski, pdf (2 MB) str. 347-352 preuzimanja: 73* citiraj
APA 6th Edition
Randić, M. i Harris, F.E. (1979). Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals. Croatica Chemica Acta, 52 (4), 347-352. Preuzeto s https://hrcak.srce.hr/195852
MLA 8th Edition
Randić, M . i F. E. Harris. "Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals." Croatica Chemica Acta, vol. 52, br. 4, 1979, str. 347-352. https://hrcak.srce.hr/195852. Citirano 25.02.2021.
Chicago 17th Edition
Randić, M . i F. E. Harris. "Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals." Croatica Chemica Acta 52, br. 4 (1979): 347-352. https://hrcak.srce.hr/195852
Harvard
Randić, M., i Harris, F.E. (1979). 'Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals', Croatica Chemica Acta, 52(4), str. 347-352. Preuzeto s: https://hrcak.srce.hr/195852 (Datum pristupa: 25.02.2021.)
Vancouver
Randić M, Harris FE. Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals. Croatica Chemica Acta [Internet]. 1979 [pristupljeno 25.02.2021.];52(4):347-352. Dostupno na: https://hrcak.srce.hr/195852
IEEE
M. Randić i F.E. Harris, "Reduction of Hybrid Electron-repulsion Integrals to Overlap Integrals", Croatica Chemica Acta, vol.52, br. 4, str. 347-352, 1979. [Online]. Dostupno na: https://hrcak.srce.hr/195852. [Citirano: 25.02.2021.]

Sažetak
It is shown how two-center electron-repulsion integrals of
hybrid type can be reduced to linear combinations of overlap
integrals. In certain cases the overlap integrals involve orbitals
whose principal quantum numbers are less than their azimuthal
quantum numbers. Explicit formulas are presented for the reduction
of all hybrid integrals containing only orbitals of principal
quantum numbers 1 or 2.

Hrčak ID: 195852

URI
https://hrcak.srce.hr/195852

Posjeta: 126 *