The He + H2+ → HeH+ + H reaction: Ab initio studies of the potential energy surface, benchmark time-independent quantum dynamics in an extended energy range and comparison with experiments-Reference-Cited by-同舟云学术

The He + H2+ → HeH+ + H reaction: Ab initio studies of the potential energy surface, benchmark time-independent quantum dynamics in an extended energy range and comparison with experiments

Published:2012-12-28 Issue:24 Volume:137 Page:244306
ISSN:0021-9606
Container-title:The Journal of Chemical Physics
language:en
Short-container-title:The Journal of Chemical Physics

Author:

De Fazio Dario,de Castro-Vitores Miguel,Aguado Alfredo,Aquilanti Vincenzo,Cavalli Simonetta

Publisher

AIP Publishing

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://aip.scitation.org/doi/pdf/10.1063/1.4772651

Reference74 articles.

1. Computational Science and Its Applications – ICCSA 2012

2. Exact activation energies and phenomenological description of quantum tunneling for model potential energy surfaces. The F+H2 reaction at low temperature

3. Experimental Born–Oppenheimer Potential for theX1Σ+Ground State of HeH+: Comparison with theAb InitioPotential

4. Convergence of Experiment and Theory on the Pure Vibrational Spectrum ofHeH+

5. Calculations for the vibration-rotation levels of H+ 2 in its ground and first excited electronic states

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