SIMBAD references

2018MNRAS.473.1438D - Mon. Not. R. Astron. Soc., 473, 1438-1443 (2018)

Rotational relaxation of CF+(X1Σ) in collision with He(1S).

DENIS-ALPIZAR O., INOSTROZA N. and CASTRO PALACIO J.C.

Abstract (from CDS):

The carbon monofluoride cation (CF+) has been detected recently in Galactic and extragalactic regions. Therefore, excitation rate coefficients of this molecule in collision with He and H2 are necessary for a correct interpretation of the astronomical observations. The main goal of this work is to study the collision of CF+ with He in full dimensionality at the close-coupling level and to report a large set of rotational rate coefficients. New ab initio interaction energies at the CCSD(T)/aug-cc-pv5z level of theory were computed, and a three-dimensional potential energy surface was represented using a reproducing kernel Hilbert space. Close-coupling scattering calculations were performed at collisional energies up to 1600 cm-1 in the ground vibrational state. The vibrational quenching cross-sections were found to be at least three orders of magnitude lower than the pure rotational cross-sections. Also, the collisional rate coefficients were reported for the lowest 20 rotational states of CF+ and an even propensity rule was found to be in action only for j > 4. Finally, the hyperfine rate coefficients were explored. These data can be useful for the determination of the interstellar conditions where this molecule has been detected.

Abstract Copyright: © 2017 The Authors Published by Oxford University Press on behalf of the Royal Astronomical Society

Journal keyword(s): astrochemistry - molecular data - molecular processes - scattering - ISM: molecules

Simbad objects: 2

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