Literature DB >> 19947678

Binary rototranslational hyper-Rayleigh spectra of H(2)-He gas mixture.

J-L Godet1, T Bancewicz, W Głaz, G Maroulis, A Haskopoulos.   

Abstract

The collision-induced rototranslational hyper-Rayleigh spectra of gaseous H(2)-He mixture are computed and discussed in the binary regime. As the input data we use our ab initio computed H(2)-He collision-induced first dipole hyperpolarizability tensor Deltabeta(R). Both the vector and the septor part of the H(2)-He hyper-Rayleigh spectra are evaluated at room temperature (T=295 K). The spectra are calculated assuming the full quantum computations based on the Schrödinger equation of the relative translational motion in the isotropic H(2)-He potential as well as using semiclassical methods.

Entities:  

Year:  2009        PMID: 19947678     DOI: 10.1063/1.3264691

Source DB:  PubMed          Journal:  J Chem Phys        ISSN: 0021-9606            Impact factor:   3.488


  1 in total

1.  Interaction-induced electric (hyper)polarizability in the dihydrogen-neon pair: basis set and electron correlation effects.

Authors:  Anastasios Haskopoulos; George Maroulis; T Bancewicz
Journal:  J Mol Model       Date:  2018-08-31       Impact factor: 1.810

  1 in total

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