On the mechanism for nitrate formation via the peroxy radical + NO reaction

Journal of Physical Chemistry A

Volumn 108, Issue 42, 2004, Pages 9082-9095

  Zhang, Jieyuan ^a   Dransfield, Tim ^b   Donahue, Neil M ^c  

^a CARNEGIE MELLON UNIVERSITY   (United States)

^b HARVARD UNIVERSITY   (United States)

^c CARNEGIE MELLON UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

COMPUTATIONAL METHODS; DECOMPOSITION; FREE RADICALS; ISOMERS; NITROGEN OXIDES; PARAMETER ESTIMATION; THERMAL EFFECTS;

ASYMPTOTES; CHAIN REACTIONS; RADICAL PRODUCTS; TRANSITION STATES;

CHEMICAL REACTIONS;

EID: 7444258466     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp048096x     Document Type: Article

References (43)

1. Atkinson, R.; Aschmann, S. M.; Winer, A. M. J. Atmos. Chem. 1987, 5, 91.
2. Atkinson, R. J. Phys. Chem. Ref. Data 1994, Monograph 2, 216.
3. Carter, W. P. L.; Atkinson, R. J. Atmos. Chem. 1989, 8, 165.
4. Chen, X.; Hulbert, D.; Shepson, P. B. J. Geophys. Res. 1998, 103, 25563.
5. Sprengnether, M.; Demerjian, K. L.; Donahue, N. M.; Anderson, J. G. J. Geophys. Res. 2002, 107, 8-1-8-13.
6. Chuong, B.; Stevens, P. S. J. Geophys. Res. 2002, 107, 2-1-2-12.
7. Zhang, D.; Lei, W.; Zhang, R. Chem. Phys. Lett. 2002, 358, 171.
8. Burkholder, J. B.; Hammer, P. D.; Howard, C. J. J. Phys. Chem. 1987, 91, 2136.
9. Mcgrath, M. P.; Francl, M. M.; Rowland, F. S.; Hehre, W. J. J. Phys. Chem. 1988, 92, 5352.
10. Li, Y.; Francisco, J. S. J. Phys. Chem. 2000, 113, 7976.
11. Dixon, D. A.; Feller, D.; Zhan, C.; Francisco, J. S. J. Phys. Chem. A 2002, 106, 3191.
12. Zhang, D.; Zhang, R. J. Am. Chem. Soc. 2002, 124, 9600.
13. Lohr, L. L.; Barker, J. R.; Shroll, R. M. J. Phys. Chem. A 2003, 107, 7429.
14. Barker, J. R.; Lohr, L. L.; Shroll, R. M.; Reading, S. J. Phys. Chem. A 2003, 107, 7434.
15. Golden, D. M.; Barker, J. R.; Lohr, L. L. J. Phys. Chem. A 2003, 107, 11057.
16. Zhao, Y.; Houk, K. N.; Olson, L. P. J. Phys. Chem. A 2004, 108, 5864.
17. Ellison, G. B.; Herbert, J. M.; McCoy, A. B.; Szalay, P. G.; Stanton, J. F. J. Phys. Chem. A, in press.
18. Chase, M. W. NIST JANAF Thermochemical Tables, 4th ed. (Journal of Physical and Chemical Reference Data, Monograph, No. 9); Technical Report; National Institute of Standards and Technology: Gaithersburg, MD, 1998.
19. Sander, S. P.; Friedl, R. R.; DeMore, W. B.; Golden, D. M.; Knrylo, M. J.; Hampson, R. F.; Huie, R. E.; Moortgat, G. K.; Ravishankara, A. R.; Kolb, C. E.; Molina, M. J. Chemical Kinetics and Photochemical Data for Use in Stratospheric Modeling, Evaluation Number 13; Technical Report 00-3; Jet Propulsion Laboratory: Pasadena, CA, 2000.
20. Atkinson, R.; Baulch, D. L.; Cox, R. A.; Crowley, J. N.; Hampson, R. F.; Kerr, J. A.; Rossi, M. J.; Troe, J. Summary of Evaluated Kinetic and Photochemical Data for Atmospheric Chemistry; Technical Report, IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry, 2002 (http://www.iupac-kinetic.ch.cam.ac.uk/).
21. Donahue, N. M.; Mohrschladt, R.; Dransfield, T. J.; Anderson, J. G.; Dubey, M. K. J. Phys. Chem. A 2001, 105, 1515.
22. Dransfield, T. J.; Donahue, N. M.; Anderson, J. G. J. Phys. Chem. A 2001, 105, 1507.
23. Atkinson, R.; Carter, W. P. L.; Winer, A. M. J. Phys. Chem. 1983, 87, 2012.
24. Troe, J. J. Phys. Chem. 1979, 83, 114.
25. Sander, S. P.; Friedl, R. R.; Huie, R. E.; Kurylo, M. J.; Orkin, V. L.; Kolb, C. E.; Moortgat, G. K.; Golden, D. M.; Ravishankara, A. R.; Molina, M. J. ; FinlaysonPitts, B. J. Chemical Kinetics and Photochemical Data for Use in Atmospheric Studies, Evaluation Number 14; Technical Report 02-25; Jet Propulsion Laboratory: Pasadena, CA, 2002.
26. Atkinson, R.; Aschmann, S. M.; Carter, W. P. L.; Winer, A. M. J. Phys. Chem. 1982, 86, 4563.
27. Arey, J.; Aschmann, S. M.; Kwok, E. S. C.; Atkinson, R. J. Atmos. Chem. A 2001, 105, 1020.
28. Abbatt, J. Studies of Gas-Phase Free-Radical Reactivity. Ph.D. Thesis, Harvard University, Cambridge, MA, 1990.
29. Herschbach, D. R.; Johnston, H. S.; Pitzer, K. S.; Powell, R. E. J. Chem. Phys. 1956, 25, 736.
30. Smith, G. P.; Golden, D. M. Int. J. Chem. Kinet. 1978, 10, 489.
31. Benson, S. W. Thermochemical Kinetics; John Wiley & Sons: New York, 1976.
32. Barker, J. R. Int. J. Chem. Kinet. 2001, 33, 232.
33. Kroll, J. H.; Sahay, S. R.; Anderson, J. G.; Demerjian, K. L.; Donahue, N. M. J. Phys. Chem. A 2001, 105, 4446.
34. Holbrook, K. A.; Pilling, M. J.; Robertson, S. H. Unimolecular Reactions; John Wiley & Sons: New York, 1996.
35. Reid, R. C.; Sherwood, T. K. The Properties of Gases and Liquids, 2nd ed.; McGraw-Hill: New York, 1966.
36. Troe, J. J. Chem. Phys. 1977, 66, 4758.
37. Orlando, J. J.; Iraci, L. T.; Tyndall, G. S. J. Phys. Chem. A 2000, 104, 5072.
38. Troe, J. Ber. Bunsen-Ges. Phys. Chem. 1974, 78, 478.
39. Baulch, D. L.; Cox, R. A.; Hampson, R. F.; Kerr, J. A.; Troe, J.; Watson, R. T. J. Phys. Chem. Ref Data 1980, 9 (2), 295.
40. Atkinson, R.; Baulch, D. L.; Cox, R. A.; Crowley, J. N.; Hampson, R. F.; Kerr, J. A.; Rossi, M. J.; Troe, J. Summary of Evaluated Kinetic and Photochemical Data for Atmospheric Chemistry; Technical Report, IUPAC Subcommittee on Gas Kinetic Data Evaluation for Atmospheric Chemistry, 2003 (http://www.iupac-kinetic.ch.cam.ac.uk/).
41. Donahue, N. M.; Dubey, M. K.; Mohrschladt, R.; Demerjian, K.; Anderson, J. G. J. Geophys. Res. 1997, 102, 6159.
42. Donahue, N. M.; Clarke, J. S. Int. J. Chem. Kinet. 2004, 36 (5), 259.
43. Hippler, H.; Nasterlack, S.; Striebel, F. Phys. Chem. Chem. Phys. 2002, 4, 2959.