Conference paper

Studies of Electronic Structure of Saturated Organic Molecules

V. Gineityte ; Institute of Physics, K. Poželos 54, Vilnius 232600, USSR
D. Shatkovskaya ; Vilnius University, Sauletekio 9, Vilnius 232051, USSR

Abstract

The common effective Hamiltonian of the class of saturated
hvdrocarbons has been constructed and the expressions of'
density matrix (DM) elements for these systems have been
obtained using the perturbation theory for DM. It has been shown
that the transferrability of the characteristics of the electronic
structure pertaining to identical atoms and bonds follows the
transferrability of the elements of DM. The heteroatom influence
on DM of saturated organic systems has been investigated.

Keywords

Hrčak ID:

175825

URI

https://hrcak.srce.hr/175825

Publication date:

25.2.1990.

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