Dynamical basis sets for algebraic variational calculations in quantum-mechanical scattering theory
about
Kinetic isotope effects for the reactions of muonic helium and muonium with H2.Army ants algorithm for rare event sampling of delocalized nonadiabatic transitions by trajectory surface hopping and the estimation of sampling errors by the bootstrap method.Quantum mechanical generalized phase-shift approach to atom-surface scattering: a Feshbach projection approach to dealing with closed channel effects.Time-dependent wave-packet forms of Schrödinger and Lippmann-Schwinger equations.Chemical Kinetics Under TestZero-point energy, tunnelling, and vibrational adiabaticity in the Mu + H2reactionKinetics of the reaction of the heaviest hydrogen atom with H2, the 4Heμ + H2 → 4HeμH + H reaction: Experiments, accurate quantal calculations, and variational transition state theory, including kinetic isotope effects for a factor of 36.1 in isoConical intersections and semiclassical trajectories: Comparison to accurate quantum dynamics and analyses of the trajectoriesH+H2Thermal Reaction: A Convergence of Theory and ExperimentThe 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 dynamicsWhat is the best semiclassical method for photochemical dynamics of systems with conical intersections?Validation of trajectory surface hopping methods against accurate quantum mechanical dynamics and semiclassical analysis of electronic-to-vibrational energy transferAlgebraic 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 moleculesImproved techniques for outgoing wave variational principle calculations of converged state‐to‐state transition probabilities for chemical reactions
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P2860
Dynamical basis sets for algebraic variational calculations in quantum-mechanical scattering theory
description
im Mai 1990 veröffentlichter wissenschaftlicher Artikel
@de
scientific article published on 01 May 1990
@en
wetenschappelijk artikel
@nl
наукова стаття, опублікована в травні 1990
@uk
name
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@en
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@nl
type
label
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@en
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@nl
prefLabel
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@en
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@nl
P2093
P2860
P356
P1433
P1476
Dynamical basis sets for algeb ...... m-mechanical scattering theory
@en
P2093
P2860
P304
P356
10.1103/PHYSREVA.41.4857
P407
P577
1990-05-01T00:00:00Z