A simple construction scheme for quasidiabatic electronic states implemented earlier for a Jahn–Teller situation [J. Chem. Phys. 110, 9371 (1999)] is extended to the case of a seam of symmetry-allowed conical intersections. It is based on the idea of removing only the singular part of the nonadiabatic coupling elements, leading to the notion of “regularized” diabatic states. Explicit working equations are given for the resulting potential energy matrix which require only information from the adiabatic potential energy surfaces alone. The approach is tested for the photodissociation of H2S and O3 and very good agreement with reference data from the literature is found.
Simultaneous imaging of laser-induced fluorescence of toluene and 3-pentanone was used to determine the local absolute oxygen and residual gas concentrations present within an engine. The technique utilizes the different sensitivities of the laser-excited molecules to quenching by molecular oxygen as a means to determine quantitative images of in-cylinder oxygen concentrations. The difference in the amount of oxygen available between two operating conditions was investigated. Results are in agreement with measurements in the exhaust gas.
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