Algorithms for the construction of high-order Kronrod rule extensions with application to sparse-grid integration

ISSN:1017-1398ISSN:1572-926

Non-Adiabatic Transitions near Avoided Crossings: Theory and Numerics

We present a review of rigorous mathematical results about non– adiabatic transitions in molecular systems that are associated with avoided crossings of electron energy level surfaces. We then present a novel numerical technique for studying these transitions that is based on expansions in semiclassical wavepackets

Adam le Bossu, Le Jeu de la Feuillée, Le Jeu de Robin et Marion

International audienc

Adam le Bossu, Le Jeu de la Feuillée, Le Jeu de Robin et Marion

International audienc

Adam le Bossu, Le Jeu de la Feuillée, Le Jeu de Robin et Marion

International audienc