Collisional rate coefficients of C3H2 and the determination of physical conditions in molecular clouds

1989 ◽  
Vol 337 ◽  
pp. 306 ◽  
Author(s):  
L. W. Avery ◽  
Sheldon Green

2020 ◽  
Vol 493 (3) ◽  
pp. 3491-3495 ◽  
Author(s):  
J Kłos ◽  
P J Dagdigian ◽  
M H Alexander ◽  
A Faure ◽  
F Lique

ABSTRACT Observations of hyperfine resolved transitions of the hydroxyl radical (OH) are unique probes of the physical conditions in molecular clouds. In particular, hyperfine intensities can be used as an effective thermometer over a wide range of molecular densities. Accurate modelling of the OH emission spectra requires the calculation of collisional rate coefficients for the excitation of OH by H2, the most abundant collisional partner in the molecular clouds. Here, we determine hyperfine resolved rate coefficients for the excitation of OH by H2 using a recently developed highly accurate potential energy surface. State-to-state rate coefficients between the lower hyperfine levels were calculated using recoupling techniques for temperature ranging from 10 to 150 K. Significant differences were found with the earlier values currently used in astrophysical models, the new rate coefficients being larger than the previous ones. Finally, we compute the excitation of the OH radical in cold molecular clouds and star-forming regions. The new rate coefficients were found to increase the hyperfine intensities by a factor of ∼1–2. Consequently, we recommend using this new set of data in any astrophysical model of OH excitation.



2011 ◽  
Vol 134 (2) ◽  
pp. 024305 ◽  
Author(s):  
Robert Toboła ◽  
Fabien Dumouchel ◽  
Jacek Kłos ◽  
François Lique


1972 ◽  
Vol 6 (1) ◽  
pp. 38-44 ◽  
Author(s):  
R. U. Datla ◽  
H. -J. Kunze ◽  
D. Petrini


2020 ◽  
Vol 498 (4) ◽  
pp. 5489-5497 ◽  
Author(s):  
C Boursier ◽  
B Mandal ◽  
D Babikov ◽  
M L Dubernet

ABSTRACT We re-introduce a semiclassical methodology based on theories developed for the determination of broadening coefficients. We show that this simple and extremely fast methodology provides results that are in good agreement with results obtained using the more sophisticate MQCT approach. This semiclassical methodology could be an alternative approach which allows to provide large sets of collisional data for very complex molecular systems. It saves time both on the determination of potential energy surfaces and on the collisional dynamical calculations. In addition, this paper provides more complete sets of rotational de-excitation cross-sections and rate coefficients of H2O perturbed by a thermal average of water molecules. Those data can be used in the radiative transfer modelling of cometary atmospheres.



2020 ◽  
Vol 494 (4) ◽  
pp. 5239-5243
Author(s):  
Paul J Dagdigian

ABSTRACT Accurate estimates of the abundance of H2S, and inferences about the unmeasured H2 density, require accurate knowledge of radiative and collisional rate coefficients. Time-independent close-coupling quantum scattering calculations have been employed to compute rate coefficients for (de-)excitation of para- and ortho-H2S in collisions with para- and ortho-H2. These calculations utilized a potential energy surface for the interaction of H2S with H2 recently computed by the explicitly correlated CCSD(T)-F12a coupled-cluster method. Rate coefficients for temperatures ranging from 5 to 500 K were calculated for all transitions among the first 19 rotational levels of H2S, whose energies are less than or equal to 405 K. These rate coefficients are compared with previous estimates of these quantities.



Author(s):  
A. Chefai ◽  
M. Ben Khalifa ◽  
F. Khadri ◽  
K. Hammami

An appropriate estimation of the abundance of the observed C5 radical in the interstellar medium requires accurate radiative and collisional rate coefficients.



1972 ◽  
Vol 14 ◽  
pp. 565-583 ◽  
Author(s):  
H.-J. Kunze

AbstractLine radiation emitted by highly ionized atoms embedded in hot laboratory plasmas can be utilized to obtain collisional rate coefficients for excitation and ionization. After a discussion of the principles underlying these measurements, the plasma device mostly used is explained briefly as are the various experimental techniques. All experimental results obtained so far are finally discussed and compared with theoretical calculations where possible.



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