Reactive quenching of OH A 2Σ + by O 2 and CO: Experimental and nonadiabatic theoretical studies of H- and O-atom product channels

Journal of Chemical Physics

Volumn 137, Issue 9, 2012, Pages

  Lehman, Julia H ^a   Lester, Marsha I ^a   Yarkony, David R ^b  

^a UNIVERSITY OF PENNSYLVANIA   (United States)

^b JOHNS HOPKINS UNIVERSITY   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AVAILABLE ENERGY; CHANNEL YIELD; COLLISIONAL QUENCHING; CONICAL INTERSECTION; DOPPLER PROFILE; FINE STRUCTURES; NON-ADIABATIC; NON-ADIABATIC COUPLING; PRODUCT BRANCHING RATIOS; PRODUCT CHANNEL; THEORETICAL STUDY; TRANSLATIONAL ENERGY DISTRIBUTIONS; TWO-PHOTON LASER-INDUCED FLUORESCENCE; VIBRATIONALLY EXCITED;

ATOMS; CARBON DIOXIDE;

QUENCHING;

EID: 84866098725     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4748376     Document Type: Article

References (54)

1. P. A. Cleary, L. P. Dempsey, C. Murray, M. I. Lester, J. Kos, and M. H. Alexander, J. Chem. Phys. 126, 204316 (2007). 10.1063/1.2730505 (Pubitemid 46872182)
2. L. P. Dempsey, C. Murray, P. A. Cleary, and M. I. Lester, Phys. Chem. Chem. Phys. 10, 1424 (2008). 10.1039/b715611a
3. L. P. Dempsey, T. D. Sechler, C. Murray, and M. I. Lester, J. Phys. Chem. A 113, 6851 (2009). 10.1021/jp902935c
4. L. P. Dempsey, T. D. Sechler, C. Murray, M. I. Lester, and S. Matsika, J. Chem. Phys. 130, 104307 (2009). 10.1063/1.3077027
5. J. H. Lehman, L. P. Dempsey, M. I. Lester, B. Fu, E. Kamarchik, and J. M. Bowman, J. Chem. Phys. 133, 164307 (2010). 10.1063/1.3487734
6. D. T. Anderson, M. W. Todd, and M. I. Lester, J. Chem. Phys. 110, 11117 (1999). 10.1063/1.479053
7. M. W. Todd, D. T. Anderson, and M. I. Lester, J. Phys. Chem. A 105, 10031 (2001). 10.1021/jp012674h (Pubitemid 35373237)
8. J. H. Lehman, J. L. Bertrand, T. A. Stephenson, and M. I. Lester, J. Chem. Phys. 135, 144303 (2011). 10.1063/1.3644763
9. M. Ortiz-Suárez, M. F. Witinski, and H. F. Davis, J. Chem. Phys. 124, 201106 (2006). 10.1063/1.2206779 (Pubitemid 43838588)
10. R. D. Kenner, F. P. Capetanakis, and F. Stuhl, J. Phys. Chem. 94, 2441 (1990). 10.1021/j100369a045
11. S. S. Xantheas, G. J. Atchity, S. T. Elbert, and K. Ruedenberg, J. Chem. Phys. 94, 8054 (1991). 10.1063/1.460140
12. D. E. Heard and D. A. Henderson, Phys. Chem. Chem. Phys. 2, 67 (2000). 10.1039/a908221b
13. P. E. Charters, R. G. Macdonald, and J. C. Polanyi, Appl. Opt. 10, 1747 (1971). 10.1364/AO.10.001747
14. D. Klenerman and I. W. M. Smith, J. Chem. Soc., Faraday Trans. 2 83, 229 (1987). 10.1039/f29878300229
15. S. D. Le Picard, M. Tizniti, A. Canosa, I. R. Sims, and I. W. M. Smith, Science 328, 1258 (2010). 10.1126/science.1184459
16. D. C. McCabe, I. W. M. Smith, B. Rajakumar, and A. R. Ravishankara, Chem. Phys. Lett. 421, 111 (2006). 10.1016/j.cplett.2006.01.037
17. U. C. Sridharan, F. S. Klein, and F. Kaufman, J. Chem. Phys. 82, 592 (1985). 10.1063/1.448973
18. J. M. Beames, M. I. Lester, C. Murray, M. E. Varner, and J. F. Stanton, J. Chem. Phys. 134, 044304 (2010). 10.1063/1.3518415
19. C. Murray, E. L. Derro, T. D. Sechler, and M. I. Lester, Acc. Chem. Res. 42, 419 (2009). 10.1021/ar8001987
20. A. Vegiri and S. C. Farantos, in Selectivity in Chemical Reactions, edited by, J. C. Whitehead, (Kluwer Academic, 1988), p. 393.
21. A. Vegiri and S. C. Farantos, Mol. Phys. 69, 129 (1990). 10.1080/00268979000100091
22. T. G. Clements and R. E. Continetti, J. Chem. Phys. 115, 5345 (2001). 10.1063/1.1404143 (Pubitemid 32962079)
23. E. Garand, K. Klein, J. F. Stanton, J. Zhou, T. I. Yacovitch, and D. M. Neumark, J. Phys. Chem. A 114, 1374 (2010). 10.1021/jp9067894
24. M. E. Greenslade, M. Tsiouris, R. T. Bonn, and M. I. Lester, Chem. Phys. Lett. 354, 203 (2002). 10.1016/S0009-2614(02)00061-1
25. B. C. Hoffman and D. R. Yarkony, J. Chem. Phys. 113, 10091 (2000). 10.1063/1.1322074 (Pubitemid 32076904)
26. D. R. Yarkony, J. Chem. Phys. 111, 6661 (1999). 10.1063/1.479966
27. B. Fu, E. Kamarchik, and J. M. Bowman, J. Chem. Phys. 133, 164306 (2010). 10.1063/1.3488167
28. E. Kamarchik, B. N. Fu, and J. M. Bowman, J. Chem. Phys. 132, 091102 (2010). 10.1063/1.3336402
29. P. Y. Zhang, R. F. Lu, T. S. Chu, and K. L. Han, J. Chem. Phys. 133, 174316 (2010). 10.1063/1.3502468
30. P. Y. Zhang, R. F. Lu, T. S. Chu, and K. L. Han, J. Phys. Chem. A 114, 6565 (2010). 10.1021/jp1024069
31. M. A. Collins, O. Godsi, S. Liu, and D. H. Zhang, J. Chem. Phys. 135, 234307 (2011). 10.1063/1.3664759
32. D. G. Truhlar, presented at the American Chemical Society, San Diego, 2012 (unpublished).
33. P. J. Dagdigian, B. E. Forch, and A. W. Miziolek, Chem. Phys. Lett. 148, 299 (1988). 10.1016/0009-2614(88)87276-2
34. Q. Li, R. T. Carter, and J. R. Huber, Chem. Phys. Lett. 334, 39 (2001). 10.1016/S0009-2614(00)01445-7 (Pubitemid 33628000)
35. A. A. Turnipseed, G. L. Vaghjiani, J. E. Thompson, and A. R. Ravishankara, J. Chem. Phys. 96, 5887 (1992). 10.1063/1.462685
36. J. Luque and D. R. Crosley, SRI International Report MP 99-009 (1999).
37. M. W. Chase, J. L. Curnutt, J. R. Downey, R. A. McDonald, A. N. Syverud, and E. A. Valenzuela, J. Phys. Chem. Ref. Data 11, 695 (1982). 10.1063/1.555666
38. R. N. Zare and D. R. Herschbach, Proc. IEEE 51, 173 (1963). 10.1109/PROC.1963.1676
39. G. Herzberg, Electronic Spectra and Electronic Structure of Polyatomic Molecules (Van Nostrand, New York, 1966).
40. M. N. R. Ashfold, R. N. Dixon, M. Kono, D. H. Mordaunt, and C. L. Reed, Philos. Trans. R. Soc. London, Ser. A 355, 1659 (1997). 10.1098/rsta.1997.0082
41. A. Barbe, A. Chichery, T. Cours, V. G. Tyuterev, and J. J. Plateaux, J. Mol. Struct. 616, 55 (2002). 10.1016/S0022-2860(02)00183-7
42. A. Chedin, J. Mol. Spectrosc. 76, 430 (1979). 10.1016/0022-2852(79)90236- 4
43. M. S. Pindzola, Phys. Rev. A 17, 1021 (1978). 10.1103/PhysRevA.17.1021
44. D. J. Bamford, M. J. Dyer, and W. K. Bischel, Phys. Rev. A 36, 3497 (1987). 10.1103/PhysRevA.36.3497
45. L. P. Dempsey, C. Murray, and M. I. Lester, J. Chem. Phys. 127, 151101 (2007). 10.1063/1.2800316 (Pubitemid 351260735)
46. M. J. Bearpark, M. A. Robb, and H. B. Schlegel, Chem. Phys. Lett. 223, 269 (1994). 10.1016/0009-2614(94)00433-1
47. M. R. Manaa and D. R. Yarkony, J. Am. Chem. Soc. 116, 11444 (1994). 10.1021/ja00104a025
48. H. Lischka, R. Shepard, R. M. Pitzer, I. Shavitt, M. Dallos, T. Muller, P. G. Szalay, F. B. Brown, R. Ahlrichs, H. J. Böhm, A. Chang, D. C. Comeau, R. Gdanitz, H. Dachsel, C. Ehrhardt, M. Ernzerhof, P. Höchtl, S. Irle, G. S. Kedziora, T. Kovar, V. Parasuk, M. J. M. Pepper, P. Scharf, H. Schiffer, M. Schindler, M. Schüler, M. Seth, E. A. Stahlberg, J.-G. Zhao, S. Yabushita, Z. Y. Zhang, M. Barbatti, S. Matsika, M. Schuurmann, D. R. Yarkony, S. R. Brozell, E. V. Beck, and J.-P. Blaudeau, COLUMBUS, an ab initio electronic structure program (2006).
49. H. Lischka, R. Shepard, R. M. Pitzer, I. Shavitt, M. Dallos, T. Muller, P. G. Szalay, M. Seth, G. S. Kedziora, S. Yabushita, and Z. Y. Zhang, Phys. Chem. Chem. Phys. 3, 664 (2001). 10.1039/b008063m (Pubitemid 32193871)
50. K. P. Huber and G. Herzberg, in NIST Chemistry WebBook, http://webbook.nist.gov.
51. D. R. Yarkony, J. Chem. Phys. 112, 2111 (2000). 10.1063/1.480779
52. J. A. Klos, P. J. Dagdigian, M. H. Alexander, F. J. Aoiz, M. Brouard, J. H. Lehman, and M. I. Lester, personal communication (2012).
53. R. A. Copeland, M. J. Dyer, and D. R. Crosley, J. Chem. Phys. 82, 4022 (1985). 10.1063/1.448843
54. J. J. Kay, G. Paterson, M. L. Costen, K. E. Strecker, K. G. McKendrick, and D. W. Chandler, J. Chem. Phys. 134, 091101 (2011). 10.1063/1.3563016