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Gradient difference vector, direct conical intersections

Robb, Bemaidi, and Olivucci (RBO) [37] developed a method based on the idea that a conical intersection can be found if one moves in a plane defined by two vectors xi and X2, defined in the adiabatic basis of the molecular Hamiltonian H. The direction of Xi corresponds to the gradient difference... [Pg.383]


See other pages where Gradient difference vector, direct conical intersections is mentioned: [Pg.936]    [Pg.100]    [Pg.106]    [Pg.128]    [Pg.229]    [Pg.211]    [Pg.94]    [Pg.396]    [Pg.128]    [Pg.173]   
See also in sourсe #XX -- [ Pg.386 , Pg.387 , Pg.388 ]

See also in sourсe #XX -- [ Pg.386 , Pg.387 , Pg.388 ]




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Conical intersection

Conical intersections gradient difference vector

Conicity

Difference vector

Directional difference

Directional vector

Gradient difference vector

Gradient difference vector, direct

Gradient direction

Gradient vector

Intersect

Vector direction

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