Geometrical Derivatives of Energy Surfaces and Molecular Properties [electronic resource] / edited by Poul Jørgensen, Jack Simons.

The development and computational implementation of analytical expres sions for the low-order derivatives of electronic energy surfaces and other molecular properties has undergone rapid growth in recent years. It is now fairly routine for chemists to make use of energy gradient information in locat...

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Bibliographic Details

Online Access:	Full Text (via Springer)
Main Author:	Jorgensen, Poul
Other Authors:	Simons, Jack
Other title:	Proceedings of the NATO Advanced Research Workshop, Sandbjerg, Denmark, August 1-4, 1985
Format:	Electronic eBook
Language:	English
Published:	Dordrecht : Springer Netherlands, 1986.
Series:	NATO ASI series. Mathematical and physical sciences ; 166.
Subjects:	Chemistry. Physical organic chemistry.