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Potential energy hypersurfaces crossings between

In this article, particular attention has been paid to the results of laboratory experiments that have provided information about the molecular dynamics of electronically adiabatic atom-exchange reactions. For a reaction like A + BC - AB + C, where the possibility of crossing between different electronic states can safely be ignored, a theoretical study comprises three distinct stages [20] (a) the determination of the potential-energy hypersurface, (b) the solution of the equations that describe the motion of A, B, and C under the influence of V, and (c) the averaging of the results of these trajectory calculations so that they reflect the distribution of collisional... [Pg.64]

See other pages where Potential energy hypersurfaces crossings between is mentioned: [Pg.18]    [Pg.935]    [Pg.24]    [Pg.439]    [Pg.207]    [Pg.226]    [Pg.487]    [Pg.553]    [Pg.1013]    [Pg.49]    [Pg.1045]    [Pg.130]    [Pg.150]    [Pg.70]    [Pg.25]    [Pg.76]    [Pg.258]    [Pg.471]    [Pg.352]    [Pg.133]    [Pg.1045]    [Pg.104]    [Pg.3071]    [Pg.29]    [Pg.35]   
See also in sourсe #XX -- [ Pg.186 , Pg.188 , Pg.223 , Pg.224 , Pg.225 , Pg.226 , Pg.227 , Pg.237 ]

See also in sourсe #XX -- [ Pg.186 , Pg.188 , Pg.223 , Pg.224 , Pg.225 , Pg.226 , Pg.227 , Pg.237 ]



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Cross potential

Crossing energy

Energy between

Energy hypersurface

Hypersurface

Potential energy hypersurface

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