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Croatica Chemica Acta, Vol. 44 No. 4, 1972.

Kratko priopćenje

Theoretical Studies on Radialenes and Related Molecules

I. Gutman ; Institute »Ruder Boskovic«, P. 0. B. 1016, 41001 Zagreb, Croatia, Yugoslavia
N. Trinajstić ; Institute »Ruder Boskovic«, P. 0. B. 1016, 41001 Zagreb, Croatia, Yugoslavia
T. Živković ; Institute »Ruder Boskovic«, P. 0. B. 1016, 41001 Zagreb, Croatia, Yugoslavia

Puni tekst: engleski pdf 2.912 Kb

str. 501-505

preuzimanja: 246

citiraj

Sažetak

For certain classes of molecules it is possible to obtain a general solution
·of the Ruckel problem, i.e. to derive expressions for the orbital energy, orbital coefficients, total n-electron energy, etc. in a closed analytical form1-5• General solutions are important because a large amount of numerical labour can be saved. Besides, they show the dependence of HMO quantities on the molecular topology, which has been recently investigated by various authors.

Ključne riječi

Hrčak ID:

197202

URI

https://hrcak.srce.hr/197202

Datum izdavanja:

20.3.1973.

Posjeta: 707 *