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Self‐Consistent methods in Hückel and extended Hückel theories
International Journal Of Quantum ChemistryPeer ReviewedMukhopadhyay A. K. +11981Journals
A self‐consistent procedure for the Hückel theory, first indicated by Harris [J. Chem. Phys. 48 , 4027 (1968)] has been fully developed. To avoid time consuming repeated orthogonal‐nonorthogonal transformations and diagonalization of large matrices, a steepest descent technique has been suggested.

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