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Quantum reaction dynamics, electronic

Quantum reaction dynamics, electronic states (Continued) diabatization matrix, 295-300 electronically diabatic representation, 292-293... [Pg.95]

QUANTUM REACTION DYNAMICS FOR MULTIPLE ELECTRONIC STATES... [Pg.179]

TV. Two-Electronic-State Quantum Reaction Dynamics Formalism for Triatomic Reactions... [Pg.179]

IV. TWO-ELECTRONIC-STATE QUANTUM REACTION DYNAMICS FORMAUISM FOR TRIATOMIC REACTIONS... [Pg.205]

Asymptotic analysis, electronic states, triatomic quantum reaction dynamics, 317—318 Azulene molecule, direct molecular dynamics, complete active space self-consistent field (CASSCF) technique, 408-410... [Pg.68]

See other pages where Quantum reaction dynamics, electronic is mentioned: [Pg.94]    [Pg.94]    [Pg.214]    [Pg.75]    [Pg.78]    [Pg.82]    [Pg.84]    [Pg.92]    [Pg.94]    [Pg.96]    [Pg.97]    [Pg.99]    [Pg.100]    [Pg.104]   


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