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/content/aip/journal/jcp/142/9/10.1063/1.4913975
1.
1.K. Yoshino, J. Esmond, and W. Parkinson, Chem. Phys. 221, 169174 (1997).
http://dx.doi.org/10.1016/S0301-0104(97)00149-3
2.
2.W. Schneider, G. Moortgat, G. Tyndall, and J. Burrows, J. Photochem. Photobiol. A 40, 195217 (1987).
http://dx.doi.org/10.1016/1010-6030(87)85001-3
3.
3.T. Corcoran, E. Beiting, and M. Mitchell, J. Mol. Spectrosc. 154, 119128 (1992).
http://dx.doi.org/10.1016/0022-2852(92)90033-K
4.
4.T. Schwartzentruber, L. Scalabrin, and I. Boyd, J. Spacecr. Rockets 45, 11961206 (2008).
http://dx.doi.org/10.2514/1.37319
5.
5.S. Gordon and B. J. McBride, Computer Program for Calculation of Complex Chemical Equilibrium Compositions and Applications (NASA Reference Publication, 1996), p. 1311.
6.
6.B. McBride, M. Zehe, and S. Gordon, NASA Report TP-2002-211556, 2002.
7.
7.J. Castro-Palacio, T. Nagy, R. Bemish, and M. Meuwly, J. Chem. Phys. 141, 164319 (2014).
http://dx.doi.org/10.1063/1.4897263
8.
8.L. Harding, H. Stark, J. Troe, and V. Ushakov, Phys. Chem. Chem. Phys. 1, 6372 (1999).
http://dx.doi.org/10.1039/a806521g
9.
9.T. S. Ho and H. Rabitz, J. Chem. Phys. 104, 25842597 (1996).
http://dx.doi.org/10.1063/1.470984
10.
10.R. D. Levine, Molecular Reaction Dynamics (Cambridge University Press, Cambridge, 2005).
11.
11.J. Duff and R. D. Sharma, J. Chem. Soc., Faraday Trans. 93, 26452649 (1997).
http://dx.doi.org/10.1039/a701533j
12.
12.R. N. Porter, L. M. Raff, and W. H. Miller, J. Chem. Phys. 63, 22142218 (1975).
http://dx.doi.org/10.1063/1.431603
13.
13.D. Frenkel and B. Smit, Understanding Molecular Simulation. From Algorithms to Applications, 2nd ed. (Academic Press, London, 2001).
14.
14.A. D. McNaught and A. Wilkinson, IUPAC. Compendium of Chemical Terminology, The Gold Book 2nd ed. (Blackwell Scientific Publications, Oxford, 1997).
15.
15.G. Valli, R. Orru, E. Clementi, A. Lagana, and S. Crocchianti, J. Chem. Phys. 102, 28252832 (1995).
http://dx.doi.org/10.1063/1.468660
16.
16.D. Baulch, C. Cobos, R. Cox, G. Frank, P. Hayman, T. Just, J. Kerr, T. Murrells, M. Pilling, J. Troe, R. Walker, and J. Warnatz, J. Phys. Chem. Ref. Data 23, 8471033 (1994).
http://dx.doi.org/10.1063/1.555953
17.
17.D. Bose and G. V. Candler, J. Chem. Phys. 107, 61366145 (1997).
http://dx.doi.org/10.1063/1.475132
18.
18.J. Huang, M. Buchowiecki, T. Nagy, J. Vanicek, and M. Meuwly, Phys. Chem. Chem. Phys. 16, 204211 (2014).
http://dx.doi.org/10.1039/C3CP53698J
19.
19.T. Clark, S. H. Garnett, and G. B. Kistiak, J. Chem. Phys. 51, 28852891 (1969).
http://dx.doi.org/10.1063/1.1672428
20.
20.L. Gurvich, I. Veyts, and C. Alcock, Thermodynamic Properties of Individual Substances, 4th ed. (Hemisphere Publishing Corp., Washington, DC, 1989).
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/content/aip/journal/jcp/142/9/10.1063/1.4913975
2015-03-04
2016-09-28

Abstract

The O(3P) + NO(2Π) → O( 3Σ ) + N(4S) reaction is among the N- and O- involving reactions that dominate the energetics of the reactive air flow around spacecraft during hypersonic atmospheric re-entry. In this regime, the temperature in the bow shock typically ranges from 1000 to 20 000 K. The forward and reverse rate coefficients for this reaction derived directly from trajectory calculations over this range of temperature are reported in this letter. Results compare well with the established equilibrium constants for the same reaction from thermodynamic quantities derived from spectroscopy in the gas phase which paves the way for large-scale in silico investigations of equilibrium rates under extreme conditions.

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