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Article Dans Une Revue Journal of Chemical Physics Année : 2008

Collision-induced hyper-Rayleigh spectrum of H2–Ar gas mixture

Tadeusz Bancewicz
  • Fonction : Auteur
Waldemar Głaz
  • Fonction : Auteur
George Maroulis
  • Fonction : Auteur

Résumé

The collision-induced hyper-Rayleigh (CIHR) spectra of the gaseous H 2 – Ar mixture are discussed in the binary regime on the basis of our ab initio computed H 2 – Ar collision-induced (CI) first dipole hyperpolarizability tensor Δ β ( R ) . A method for the computation of the spherical, rotationally adapted components Δ β λ L ( s , K ) ( R ) of Δ β ( R ) needed for spectroscopic line shape analysis is proposed. Both the vector and the septor parts of the H 2 – Ar CIHR spectrum are evaluated at room ( T = 295 K ) temperature. The spectra are calculated assuming the full quantum computations based on the Schrödinger equation of the relative translational motion of H 2 – Ar as well as semiclassical methods (classical trajectory approach and Birnbaum–Cohen model translational profiles). The H 2 – Ar pair CIHR septor spectrum has been found stronger than the vector one.

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Dates et versions

hal-03436307 , version 1 (19-11-2021)

Identifiants

Citer

Tadeusz Bancewicz, Waldemar Głaz, Jean-Luc Godet, George Maroulis. Collision-induced hyper-Rayleigh spectrum of H2–Ar gas mixture. Journal of Chemical Physics, 2008, 129 (12), pp.124306. ⟨10.1063/1.2981042⟩. ⟨hal-03436307⟩

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