Algebraic variational and propagation formalisms for quantal dynamics calculations of electronic‐to‐vibrational, rotational energy transfer and application to the quenching of the 3pstate of sodium by hydrogen molecules

Algebraic variational and propagation formalisms for quantal dynamics calculations of electronic‐to‐vibrational, rotational energy transfer and application to the quenching of the 3pstate of sodium by hydrogen molecules

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http://www.wikidata.org/entity/Q57402432
Quantum mechanical reaction rate constants by vibrational configuration interaction: the OH + H2->H2O + H reaction as a function of temperature.A neural network potential energy surface for the NaH2 system and dynamics studies on the H(2S) + NaH(X1Σ+) → Na(2S) + H2(X1Σg+) reaction.Space-time contours to treat intense field-dressed molecular states. I. Theory.Direct diabatization of electronic states by the fourfold way. II. Dynamical correlation and rearrangement processesThe direct calculation of diabatic states based on configurational uniformityPhotodissociation of LiFH and NaFH van der Waals complexes: A semiclassical trajectory studyThe treatment of classically forbidden electronic transitions in semiclassical trajectory surface hopping calculationsQuantized dynamical bottlenecks and transition state control of the reaction of D with H2: Effect of varying the total angular momentumContinuous surface switching: An improved time-dependent self-consistent-field method for nonadiabatic dynamicsAnalytic potential energy surfaces and their couplings for the electronically nonadiabatic chemical processes Na(3p)+H2→Na(3s)+H2 and Na(3p)+H2→NaH+HWhat is the best semiclassical method for photochemical dynamics of systems with conical intersections?Statistical model for nonadiabatic decay of an exciplex strongly coupled to a dissociative continuumValidation of trajectory surface hopping methods against accurate quantum mechanical dynamics and semiclassical analysis of electronic-to-vibrational energy transfer
P2860

Algebraic variational and propagation formalisms for quantal dynamics calculations of electronic‐to‐vibrational, rotational energy transfer and application to the quenching of the 3pstate of sodium by hydrogen molecules

Item
http://www.wikidata.org/entity/Q57402432
description
article
@en
im April 1994 veröffentlichter wissenschaftlicher Artikel
@de
wetenschappelijk artikel
@nl
наукова стаття, опублікована у квітні 1994
@uk
name
Algebraic variational and prop ...... f sodium by hydrogen molecules
@en
Algebraic variational and prop ...... f sodium by hydrogen molecules
@nl
type
label
Algebraic variational and prop ...... f sodium by hydrogen molecules
@en
Algebraic variational and prop ...... f sodium by hydrogen molecules
@nl
prefLabel
Algebraic variational and prop ...... f sodium by hydrogen molecules
@en
Algebraic variational and prop ...... f sodium by hydrogen molecules
@nl
P1433
P1476
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P356
P1433
P1476
Algebraic variational and prop ...... f sodium by hydrogen molecules
@en
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577