Title of article
On the non-orthogonal basis set calculations of the bridge-mediated electronic matrix elements
Author/Authors
Stuchebrukhov، نويسنده , , Alexei A.، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 1997
Pages
6
From page
643
To page
648
Abstract
A simple derivation of the tunneling superexchange matrix element for long-distance electron transfer reactions is presented. Non-orthogonality (overlaps) of the donor and acceptor orbitals and the bridging orbitals are explicitly taken into account.
Journal title
Chemical Physics Letters
Serial Year
1997
Journal title
Chemical Physics Letters
Record number
1772016
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