Dissociative photoionization of sulfur chlorides and oxochlorides: Thermochemistry and bond energies based on accurate appearance energies

Journal of Physical Chemistry A

Volumn 114, Issue 34, 2010, Pages 9115-9123

  Borkar, Sampada ^a   Ooka, Lauren ^a   Bodi, Andras ^b   Gerber, Thomas ^b   Sztàray, Bàlint ^a  

^a UNIVERSITY OF THE PACIFIC   (United States)

^b PAUL SCHERRER INSTITUTE   (Switzerland)

Author keywords

[No Author keywords available]

Indexed keywords

APPEARANCE ENERGY; BOND ENERGIES; BREAKDOWN CURVES; CHLORINE ATOM; DISSOCIATIVE PHOTOIONIZATION; ENERGY DISTRIBUTIONS; FRAGMENT IONS; FRANCK-CONDON; HEAT OF FORMATION; MOLECULAR IONS; OXOCHLORIDES; PHOTOELECTRON-PHOTOION COINCIDENCE; PHOTON ENERGY; PHOTON ENERGY RANGE; PRECURSOR MOLECULES; STATISTICAL MODELS; THIONYL CHLORIDES; THRESHOLD ELECTRONS; THRESHOLD IONIZATION; TRANSLATIONAL DEGREES OF FREEDOMS;

CHLORINE; CHLORINE COMPOUNDS; DEGREES OF FREEDOM (MECHANICS); IONS; PHOTOIONIZATION; PHOTONS; SULFUR; THERMOCHEMISTRY; THREE DIMENSIONAL;

PHOTODISSOCIATION;

EID: 77956165818     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp105151c     Document Type: Article

References (65)

1. Crutzen, P. J. Geophys. Res. Lett. 1976, 3 (2) 73-76
2. Finlayson, B. J.; Pitts, J. N. Science 1976, 192 (4235) 111-119
3. Graedl, T. E. Geophys. Res. Lett. 1976, 3) 181
4. Heicklen, J. Atmospheric Chemistry; Academic Press: New York, N.Y., 1976.
5. Brasseur, G. P.; Orlando, J. J.; Tyndall, G. S. Atmospheric Chemistry and Global Change; Oxford University Press: New York: 1999.
6. Unger, T. A. Pesticide Synthesis Handbook; Noyes Publication: 1996.
7. Lambropoulou, D. A.; Konstantinou, I. K.; Albanis, T. A. J. Chromatogr. A 2000, 893 (1) 143-156
8. Rowland, F. S.; Molina, M. J. Rev. Geophys. 1975, 13 (1) 1-35
9. Rodgers, S. D.; Charnley, S. B. Adv. Space Res. 2006, 38 (9) 1928-1931
10. Feldman, P. D.; Ake, T. B.; Berman, A. F.; Moos, H. W.; Sahnow, D. J.; Strobel, D. F.; Weaver, H. A.; Young, P. R. Bull. Am. Astron. Soc. 2000, 32, 34-01
11. Kuppers, M.; Schneider, N. M. Geophys. Res. Lett. 2000, 27 (4) 513-516
12. Retherford, K. D.; Feldman, P. D.; Moos, H. W.; Strobel, D. F.; Wolven, B. C.; Oliversen, R. J.; McGrath, M. A.; Roesler, F. L.; Scherb, F.; Ballester, G. E.; Smyth, W. H.; Bagenal, F. Bull. Am. Astron. Soc. 2000, 32, 34-06
13. Schneider, N. M.; Park, A. H.; Kuppers, M. E. Bull. Am. Astron. Soc. 2000, 32, 35-03
14. Spencer, J. R.; Jessup, K. L.; McGrath, M. A.; Ballester, G. E.; Yelle, R. Science 2000, 288 (5469) 1208-1210
15. Moses, J. I.; Zolotov, M. Y.; Fegley, B. Icarus 2002, 156 (1) 107-135
16. Glidewell, C.; Walton, J. C. J. Chem. Soc., Chem. Commun. 1977, 24, 915-916
17. Uemura, S.; Okazaki, H.; Onoe, A.; Okano, M. Bull. Chem. Soc. Jpn. 1978, 51 (12) 3568-3570
18. Steudeul, R. Elemental Sulfur and Surfur-rich Compounds; Springer: 2003; Vol. I.
19. Silva, A. R.; Martins, M.; Freitas, M. M. A.; Valente, A.; Freire, C.; de Castro, B.; Figueiredo, J. L. Microporous Mesoporous Mater. 2002, 55 (3) 275-284
20. Kirk, R. E.; Othmer, D. F. Encyclopedia of Chemical Technology; Third ed.; 1983; Vol. 22.
21. Chase, M. W., Jr. NIST-JANAF Thermochemical Tables J. Phys. Chem. Ref. Data 1998, 9 Monograph
22. Lodders, K. J. Phys. Chem. Ref. Data 2004, 33 (1) 357-367
23. Denis, P. A. Chem. Phys. Lett. 2003, 382 (12) 65-70
24. Miller, T. M.; Arnold, S. T.; Viggiano, A. A. Int. J. Mass Spectrom. 2003, 227 (3) 413-420
25. Goumri, A.; Shao, D. D.; Marshall, P. J. Chem. Phys. 2004, 121 (20) 9999-10005
26. Denis, P. A. J. Sulfur Chem. 2008, 29 (34) 327-352
27. Williams, T. G.; Wilson, A. K. J. Sulfur Chem. 2008, 29 (34) 353-365
28. Wang, N. X.; Wilson, A. K. J. Phys. Chem. A 2003, 107 (34) 6720-6724
29. Wilson, A. K.; Dunning, T. H. J. Phys. Chem. A 2004, 108 (15) 3129-3133
30. Wang, N. X.; Wilson, A. K. J. Phys. Chem. A 2005, 109 (32) 7187-7196
31. Baer, T.; Sztaray, B.; Kercher, J. P.; Lago, A. F.; Bodi, A.; Skull, C.; Palathinkal, D. Phys. Chem. Chem. Phys. 2005, 7 (7) 1507-1513
32. Baer, T.; Li, Y. Int. J. Mass Spectrom. 2002, 219 (3) 381-389
33. Sztaray, B.; Baer, T. Rev. Sci. Instrum. 2003, 74 (8) 3763-3768
34. Kercher, J. P.; Stevens, W.; Gengeliczki, Z.; Baer, T. Int. J. Mass Spectrom. 2007, 267 (13) 159-166
35. Bodi, A.; Johnson, M.; Gerber, T.; Gengeliczki, Z.; Sztaray, B.; Baer, T. Rev. Sci. Instrum. 2009, 80 (3 034101034107
36. Garcia, G. A.; Soldi-Lose, H.; Nahon, L. Rev. Sci. Instrum. 2009, 80 (2 023102/1023102/12
37. Tang, X. F.; Zhou, X. G.; Niu, M. L.; Liu, S. L.; Sun, J. D.; Shan, X. B.; Liu, F. Y.; Sheng, L. S. Rev. Sci. Instrum. 2009, 80 (11) 113101/1-113101/10
38. Bodi, A.; Sztaray, B.; Baer, T.; Johnson, M.; Gerber, T. Rev. Sci. Instrum. 2007, 78 (8 084102084108
39. Solouki, B.; Rosmus, P.; Bock, H. Chem. Phys. Lett. 1974, 26 (1) 20-24
40. Kaufel, R.; Vahl, G.; Minkwitz, R.; Baumgartel, H. Z. Anorg. Allg. Chem. 1981, 481 (10) 207-217
41. Liao, C. L.; Ng, C. Y. J. Chem. Phys. 1986, 84 (2) 778-782
42. Wagman, D. D.; Evans, W. H. E.; Parker, V. B.; Schum, R. H.; Halow, I.; Mailey, S. M.; Churney, K. L.; Nuttall, R. L. The NBS Tables-Selected Values of Chemical Thermodynamic Properties-Tech. Note 2703. NSRDS; US Government Printing Office: WA, 1968.
43. Norwood, K.; Ng, C. Y. Chem. Phys. Lett. 1989, 156 (23) 145-150
44. Wang, L. H.; Lee, Y. T.; Shirley, D. A. J. Chem. Phys. 1987, 87 (5) 2489-2497
45. Schlessinger, G. G. Inorganic Laboratory Preparations; Chemical Pub. Co.: New York, 1962.
46. Johnson, M.; Bodi, A.; Schulz, L.; Gerber, T. Nucl. Instrum. Methods Phys. Res. Sect. A 2009, 610 (2) 597-603
47. Ralchenku, Y.; Kramida, A. E.; Reader, J.; NIST ASD Team (2008) NIST Atomic Spectra Database; National Institute of Standards & Technology: Gaithersburg, MD, 2008.
48. Becke, A. D. J. Chem. Phys. 1993, 98 (7) 5648-5652
49. Krishnan, R.; Binkley, J. S.; Seeger, R.; Pople, J. A. J. Chem. Phys. 1980, 72 (1) 650-654
50. Curtiss, L. A.; Mcgrath, M. P.; Blaudeau, J. P.; Davis, N. E.; Binning, R. C.; Radom, L. J. Chem. Phys. 1995, 103 (14) 6104-6113
51. Glukhovtsev, M. N.; Pross, A.; Mcgrath, M. P.; Radom, L. J. Chem. Phys. 1995, 103 (5) 1878-1885
52. Curtiss, L. A.; Raghavachari, K.; Redfern, P. C.; Rassolov, V.; Pople, J. A. J. Chem. Phys. 1998, 109 (18) 7764-7776
53. Baboul, A. G.; Curtiss, L. A.; Redfern, P. C.; Raghavachari, K. J. Chem. Phys. 1999, 110 (16) 7650-7657
54. Montgomery, J. A.; Frisch, M. J.; Ochterski, J. W.; Petersson, G. A. J. Chem. Phys. 1999, 110 (6) 2822-2827
55. Montgomery, J. A.; Frisch, M. J.; Ochterski, J. W.; Petersson, G. A. J. Chem. Phys. 2000, 112 (15) 6532-6542
56. Martin, J. M. L.; de Oliveira, G. J. Chem. Phys. 1999, 111 (5) 1843-1856
57. Parthiban, S.; Martin, J. M. L. J. Chem. Phys. 2001, 114 (14) 6014-6029
58. Barnes, E. C.; Petersson, G. A.; Montgomery, J. A.; Frisch, M. J.; Martin, J. M. L. J. Chem. Theory Comput. 2009, 5 (10) 2687-2693
59. Bodi, A.; Kercher, J. P.; Bond, C.; Meteesatien, P.; Sztaray, B.; Baer, T. J. Phys. Chem. A 2006, 110 (50) 13425-13433
60. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Montgomery, J. A., Jr.; Vreven, T.; Kudin, K. N.; Burant, J. C.; Millam, J. M.; Iyengar, S. S.; Tomasi, J.; Barone, V.; Mennucci, B.; Cossi, M.; Scalmani, G.; Rega, N.; Petersson, G. A.; Nakatsuji, H.; Hada, M.; Ehara, M.; Toyota, K.; Fukuda, R.; Hasegawa, J.; Ishida, M.; Nakajima, T.; Honda, Y.; Kitao, O.; Nakai, H.; Klene, M.; Li, X.; Knox, J. E.; Hratchian, H. P.; Cross, J. B.; Bakken, V.; Adamo, C.; Jaramillo, J.; Gomperts, R.; Stratmann, R. E.; Yazyev, O.; Austin, A. J.; Cammi, R.; Pomelli, C.; Ochterski, J. W.; Ayala, P. Y.; Morokuma, K.; Voth, G. A.; Salvador, P.; Dannenberg, J. J.; Zakrzewski, V. G.; Dapprich, S.; Daniels, A. D.; Strain, M. C.; Farkas, O.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Ortiz, J. V.; Cui, Q.; Baboul, A. G.; Clifford, S.; Cioslowski, J.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Challacombe, M.; Gill, P. M. W.; Johnson, B.; Chen, W.; Wong, M. W.; Gonzalez, C.; Pople, J. A. Gaussian 03, Revision E.01; Gaussian, Inc.: Wallingford, CT, 2004.
61. Mayer, P. M.; Baer, T. Chem. Phys. Lett. 1996, 261 (12) 155-159
62. Chadwick, D.; Frost, D. C.; Herring, F. G.; Katrib, A.; Mcdowell, C. A.; Mclean, R. A. N. Can. J. Chem. 1973, 51 (12) 1893-1905
63. Guyon, P. M.; Baer, T.; Nenner, I. J. Chem. Phys. 1983, 78 (6) 3665-3672
64. Chupka, W. A.; Miller, P. J.; Eyler, E. E. J. Chem. Phys. 1988, 88 (5) 3032-3036
65. Bodi, A.; Shuman, N. S.; Baer, T. Phys. Chem. Chem. Phys. 2009, 11 (46) 11013-11021