The excitation of OH by H2 revisited - I: fine-structure resolved rate coefficients

被引:9
作者
Klos, J. [1 ]
Ma, Q. [2 ,5 ]
Dagdigian, P. J. [2 ]
Alexander, M. H. [1 ]
Faure, A. [3 ]
Lique, F. [1 ,4 ]
机构
[1] Univ Maryland, Dept Chem & Biochem, College Pk, MD 20742 USA
[2] Johns Hopkins Univ, Dept Chem, Baltimore, MD 21218 USA
[3] UJF Grenoble 1, CNRS, IPAG, UMR 5274, F-38041 Grenoble, France
[4] Univ Havre, CNRS, LOMC UMR 6294, 25 Rue Philippe Lebon,BP 1123, F-76063 Le Havre, France
[5] Univ Stuttgart, Inst Theoret Chem, Pfaffenwaldring 55, D-70569 Stuttgart, Germany
基金
美国国家科学基金会;
关键词
molecular data; molecular processes; ISM: abundances; POTENTIAL-ENERGY SURFACE; ROTATIONAL-EXCITATION; INTERSTELLAR-MEDIUM; OH-H2; COLLISIONS;
D O I
10.1093/mnras/stx1968
中图分类号
P1 [天文学];
学科分类号
0704 ;
摘要
Observations of OH in molecular clouds provide crucial constraints on both the physical conditions and the oxygen and water chemistry in these clouds. Accurate modelling of the OH emission spectra requires the calculation of rate coefficients for excitation of OH by collisions with the most abundant collisional partner in the molecular clouds, namely the H-2 molecule. We report here theoretical calculations for the fine-structure excitation of OH by H-2 (both para-and ortho-H-2) using a recently developed highly accurate potential energy surface. Full quantum close coupling rate coefficients are provided for temperatures ranging from 10 to 150 K. Propensity rules are discussed and the new OH-H-2 rate coefficients are compared to the earlier values that are currently used in astrophysical modelling. Significant differences were found: the new rate coefficients are significantly larger. As a first application, we simulate the excitation of OH in typical cold molecular clouds and star-forming regions. The new rate coefficients predict substantially larger line intensities. As a consequence, OH abundances derived from observations will be reduced from the values predicted by the earlier rate coefficients.
引用
收藏
页码:4249 / 4255
页数:7
相关论文
共 29 条
[1]   COLLISION-INDUCED TRANSITIONS BETWEEN MOLECULAR HYPERFINE LEVELS - QUANTUM FORMALISM, PROPENSITY RULES, AND EXPERIMENTAL-STUDY OF CABR(X-2-SIGMA+)+AR [J].
ALEXANDER, MH ;
DAGDIGIAN, PJ .
JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (05) :2191-2200
[2]   HYDROXYL AS A TRACER OF H2 IN THE ENVELOPE OF MBM40 [J].
Cotten, David L. ;
Magnani, Loris ;
Wennerstrom, Elizabeth A. ;
Douglas, Kevin A. ;
Onello, Joseph S. .
ASTRONOMICAL JOURNAL, 2012, 144 (06)
[3]   Magnetic Fields in Molecular Clouds [J].
Crutcher, Richard M. .
ANNUAL REVIEW OF ASTRONOMY AND ASTROPHYSICS, VOL 50, 2012, 50 :29-63
[4]   BASECOL2012: A collisional database repository and web service within the Virtual Atomic and Molecular Data Centre (VAMDC) [J].
Dubernet, M-L ;
Alexander, M. H. ;
Ba, Y. A. ;
Balakrishnan, N. ;
Balanca, C. ;
Ceccarelli, C. ;
Cernicharo, J. ;
Daniel, F. ;
Dayou, F. ;
Doronin, M. ;
Dumouchel, F. ;
Faure, A. ;
Feautrier, N. ;
Flower, D. R. ;
Grosjean, A. ;
Halvick, P. ;
Klos, J. ;
Lique, F. ;
McBane, G. C. ;
Marinakis, S. ;
Moreau, N. ;
Moszynski, R. ;
Neufeld, D. A. ;
Roueff, E. ;
Schilke, P. ;
Spielfiedel, A. ;
Stancil, P. C. ;
Stoecklin, T. ;
Tennyson, J. ;
Yang, B. ;
Vasserot, A-M. ;
Wiesenfeld, L. .
ASTRONOMY & ASTROPHYSICS, 2013, 553
[5]   OH 18 cm TRANSITION AS A THERMOMETER FOR MOLECULAR CLOUDS [J].
Ebisawa, Yuji ;
Inokuma, Hiroshi ;
Sakai, Nami ;
Menten, Karl M. ;
Maezawa, Hiroyuki ;
Yamamoto, Satoshi .
ASTROPHYSICAL JOURNAL, 2015, 815 (01)
[6]   The impact of collisional rate coefficients on molecular hyperfine selective excitation [J].
Faure, A. ;
Lique, F. .
MONTHLY NOTICES OF THE ROYAL ASTRONOMICAL SOCIETY, 2012, 425 (01) :740-748
[7]   Interstellar Hydrides [J].
Gerin, Maryvonne ;
Neufeld, David A. ;
Goicoechea, Javier R. .
ANNUAL REVIEW OF ASTRONOMY AND ASTROPHYSICS, VOL 54, 2016, 54 :181-225
[8]   OH emission from warm and dense gas in the Orion Bar PDR [J].
Goicoechea, J. R. ;
Joblin, C. ;
Contursi, A. ;
Berne, O. ;
Cernicharo, J. ;
Gerin, M. ;
Le Bourlot, J. ;
Bergin, E. A. ;
Bell, T. A. ;
Roellig, M. .
ASTRONOMY & ASTROPHYSICS, 2011, 530
[9]   Bound states of the OH(2Π)-HCl complex on ab initio diabatic potentials [J].
Groenenboom, Gerrit C. ;
Fishchuk, Anna V. ;
van der Avoird, Ad .
JOURNAL OF CHEMICAL PHYSICS, 2009, 131 (12)
[10]  
Harju J, 2000, ASTRON ASTROPHYS, V353, P1065