Control theory applied to quantum chemistry: some tracks

Free access article

Issue		ESAIM: Proc. Volume 8, 2000 Contrôle des systèmes gouvernés par des équations aux dérivées partielles


Page(s)		77 - 94
DOI		http://dx.doi.org/10.1051/proc:2000006

ESAIM: Proc., 2000, Vol. 8, pp. 77-94
DOI: 10.1051/proc:2000006

Control theory applied to quantum chemistry: some tracks

Claude Le Bris

CERMICS, Ecole Nationale des Ponts et Chaussées, 6 & 8 Av. Blaise Pascal, 77455 Champs-sur-Marne, France

Abstract
We present a short introduction to the models in use for the simulation of the evolution of a molecular system in the context of Quantum Chemistry. We explain how these models can provide experts at control theory with interesting topics of investigation, and how control theory can in turn be of great usefulness in the modelling of the laser control of chemical reactions. Some tracks for mathematical investigations are indicated.

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