Biradicalic excited states of zwitterionic phenol-ammonia clusters

Journal of Chemical Physics

Volumn 130, Issue 2, 2009, Pages

  Carrera, A ^a   Nielsen, I B ^b   Carabal P ^b,c   Dedonder, C ^b,c   Broquier, M ^b,c   Jouvet, C ^b,c   Domcke, W ^d   Sobolewski, A L ^e  

^a UNIVERSIDAD DE BUENOS AIRES   (Argentina)

^b UNIVERSITÉ PARIS SACLAY   (France)

^c CNRS   (France)

^d TECHNICAL UNIVERSITY OF MUNICH   (Germany)

^e INSTITUTE OF PHYSICS   (Poland)

Author keywords

[No Author keywords available]

Indexed keywords

EXCITED STATES; FREE RADICAL REACTIONS; GROUND STATE; HYDROGEN; IONIC STRENGTH; PHENOLS;

AB INITIO; AB INITIO CALCULATIONS; AMMONIA CLUSTERS; AMMONIA MOLECULES; CHARGE SEPARATION (CS); ELECTRON TRANSFER PROCESS (ETP); PUMP PROBES; SMALL CLUSTERS; STRUCTURE CALCULATIONS; TIME SCALING;

AMMONIA;

EID: 58449111298     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3054292     Document Type: Article

References (90)

1. O. Cheshnovsky and S. Leutwyler, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(85)87143-8 121, 1 (1985).
2. O. Cheshnovsky and S. Leutwyler, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.453820 88, 4127 (1988).
3. R. Knochenmuss, O. Cheshnovsky, and S. Leutwyler, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(88)87121-5 144, 317 (1988).
4. T. Droz, R. Knochenmuss, and S. Leutwyler, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.458693 93, 4520 (1990).
5. T. Bürgi, T. Droz, and S. Leutwyler, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(95)01107-K 246, 291 (1995).
6. R. Knochenmuss, I. Fisher, and D. C. Lührs, Isr. J. Chem. 39, 221 (1999). 0021-2148
7. D. C. Lührs, R. Knochenmuss, and I. Fisher, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b005839o 2, 4335 (2000).
8. D. Henseler, C. Tanner, H. M. Frey, and S. Leutwyler, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1389308 115, 4055 (2001).
9. R. Knochenmuss, K. M. Solntsev, and L. M. Tolbert, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp010011u 105, 6393 (2001).
10. R. Knochenmuss and I. Fischer, Int. J. Mass Spectrom. 220, 343 (2002). 1387-3806
11. C. Tanner, D. Henseler, S. Leutwyler, L. L. Connell, and P. M. Felker, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1568073 118, 9157 (2003).
12. J. Steadman and J. A. Syage, J. Phys. Chem. 92, 4630 (1990). 0022-3654
13. J. A. Syage and J. Steadman, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.460954 95, 2497 (1991).
14. J. Steadman and J. A. Syage, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100178a018 95, 10326 (1991).
15. J. A. Syage and J. Steadman, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100203a009 96, 9606 (1992).
16. J. A. Syage, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(93) 85270-X 202, 227 (1993).
17. J. A. Syage, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100150a013 97, 12523 (1993).
18. J. A. Syage, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100016a009 99, 5772 (1995).
19. J. J. Breen, L. W. Peng, D. Willberg, M. A. Heikal, P. Cong, and A. H. Zewail, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.458384 92, 805 (1990).
20. S. K. Kim, J. K. Wang, and A. H. Zewail, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(94)00951-1 228, 369 (1994).
21. S. K. Kim, J. J. Breen, D. M. Willberg, L. W. Peng, A. Heikal, J. A. Syage, and A. H. Zewail, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100019a027 99, 7421 (1995).
22. M. F. Hineman, G. A. Brucker, D. F. Kelley, and E. R. Bernstein, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.462971 97, 3341 (1992).
23. M. F. Hineman, D. F. Kelley, and E. R. Bernstein, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.466053 99, 4533 (1993).
24. D. Solgadi, C. Jouvet, and A. Tramer, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100323a001 92, 3313 (1988).
25. C. Jouvet, C. Dedonder-Lardeux, M. Richard-Viard, D. Solgadi, and A. Tramer, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100375a051 94, 5041 (1990).
26. C. Jacoby, P. Hering, M. Schmitt, W. Roth, and K. Kleinermanns, Chem. Phys. CMPHC2 0301-0104 10.1016/S0301-0104(98)00251-1 239, 23 (1998).
27. S. Martrenchard-Barra, C. Dedonder-Lardeux, C. Jouvet, D. Solgadi, M. Vervloet, G. Gregoire, and I. Dimicoli, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(99)00764-2 310, 173 (1999).
28. G. A. Pino, C. Dedonder-Lardeux, G. Gregoire, C. Jouvet, S. Martrenchard, and D. Solgadi, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.480437 111, 10747 (1999).
29. G. Pino, G. Gregoire, C. Dedonder-Lardeux, C. Jouvet, S. Martrenchard, and D. Solgadi, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/a908497e 2, 893 (2000).
30. G. Gregoire, C. Dedonder-Lardeux, C. Jouvet, S. Martrenchard, A. Peremans, and D. Solgadi, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp001475f 104, 9087 (2000).
31. G. Gregoire, C. Dedonder-Lardeux, C. Jouvet, S. Martrenchard, and D. Solgadi, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp0046039 105, 5971 (2001).
32. O. David, C. Dedonder-Lardeux, and C. Jouvet, Int. Rev. Phys. Chem. IRPCDL 0144-235X 10.1080/01442350210164287 21, 499 (2002).
33. W. Siebrand, M. Z. Zgierski, Z. K. Smedarchina, M. Vener, and J. Kaneti, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(96)01506-0 266, 47 (1997).
34. M. Yi and S. Scheiner, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(96)01135-9 262, 567 (1996).
35. S. Ishiuchi, M. Saeki, M. Sakai, and M. Fujii, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(00)00389-4 322, 27 (2000).
36. S. Ishiuchi, M. Sakai, K. Daigoku, U. Tadashi, T. Yamanaka, K. Hashimoto, and M. Fujii, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(01)01017-X 347, 87 (2001).
37. S. Ishiuchi, K. Daigoku, M. Saeki, K. Hashimoto, M. Sakai, and M. Fujii, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1508103 117, 7077 (2002).
38. S. Ishiuchi, K. Daigoku, K. Hashimoto, and M. Fujii, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1640352 120, 3215 (2004).
39. S. Ishiuchi, M. Sakai, K. Daigoku, K. Hashimoto, and M. Fujii, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2806182 127, 234304 (2007).
40. A. L. Sobolewski and W. Domcke, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp011260l 105, 9275 (2001).
41. A. L. Sobolewski, W. Domcke, C. Dedonder-Lardeux, and C. Jouvet, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b110941n 4, 1093 (2002).
42. W. Domcke and A. L. Sobolewski, Science SCIEAS 0036-8075 10.1126/science.1093081 302, 1693 (2003).
43. C. M. Tseng, Y. T. Lee, and C. -K. Ni, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1781153 121, 2459 (2004).
44. M. G. D. Nix, A. L. Devine, B. Cronin, R. N. Dixon, and M. N. R. Ashfold, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.2353818 125, 133318 (2006).
45. M. N. R. Ashfold, B. Cronin, A. L. Devine, R. N. Dixon, and M. G. D. Nix, Science SCIEAS 0036-8075 10.1126/science.1125436 312, 1637 (2006).
46. A. Iqbal, L. -J. Pegg, and V. G. Stavros, J. Phys. Chem. A (in press).
47. G. Grabner, G. Kohler, J. Zechner, and N. Getoff, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100460a005 84, 3000 (1980).
48. A. Bussandri and H. van Willigen, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp013526u 106, 1524 (2002).
49. N. Tsuji, S. Ishiuchi, M. Sakai, M. Fujii, T. Ebata, C. Jouvet, and C. Dedonder-Lardeux, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b511619h 8, 114 (2006).
50. C. Dedonder-Lardeux, D. Grosswasser, C. Jouvet, and S. Martrenchard, PhysChemComm PHCCFX 1460-2733 10.1039/b100573l 4, 21 (2001).
51. V. Stert, L. Hesse, H. Lippert, C. P. Schulz, and W. Radloff, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp0156120 106, 5051 (2002).
52. H. Lippert, V. Stert, L. Hesse, C. P. Schulz, W. Radloff, and I. V. Hertel, Eur. Phys. J. D EPJDF6 1434-6060 10.1140/epjd/e2002-00161-8 20, 445 (2002).
53. B. C. Dian, A. Longarte, and T. S. Zwier, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1536616 118, 2696 (2003).
54. O. David, C. Dedonder-Lardeux, C. Jouvet, H. Kang, S. Martrenchard, T. Ebata, and A. L. Sobolewski, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1704639 120, 10101 (2004).
55. C. Tanner, C. Manca, and S. Leutwyler, Science SCIEAS 0036-8075 10.1126/science.1091708 302, 1736 (2003).
56. C. Tanner, C. Manca, and S. Leutwyler, Chimia CHIMAD 0009-4293 10.2533/000942904777678037 58, 234 (2004).
57. C. Manca, C. Tanner, and S. Leutwyler, Chimia 58, 287 (2004). 0009-4293
58. C. Manca, C. Tanner, S. Coussan, A. Bach, and S. Leutwyler, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1769371 121, 2578 (2004).
59. C. Tanner, C. Manca, and S. Leutwyler, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1924410 122, 204326 (2005).
60. C. Manca, C. Tanner, and S. Leutwyler, Int. Rev. Phys. Chem. IRPCDL 0144-235X 10.1080/01442350500390912 24, 457 (2005).
61. C. Tanner, M. Thut, A. Steinlin, C. Manca, and S. Leutwyler, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp056151b 110, 1758 (2006).
62. W. Siebrand, M. Z. Zgierski, and Z. K. Smedarchina, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(97)01056-7 279, 377 (1997).
63. M. V. Vener and S. Iwata, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(98)00663-0 292, 87 (1998).
64. J. C. Mialocq, E. Amouyal, A. Bernas, and D. Grand, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100213a022 86, 3173 (1982).
65. A. Bernas, D. Grand, and E. Amouyal, J. Phys. Chem. JPCHAX 0022-3654 10.1021/j100447a039 84, 1259 (1980).
66. J. Peon, G. C. Hess, J. M. L. Pecourt, T. Yuzawa, and B. Kohler, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp9840782 103, 2460 (1999).
67. A. L. Sobolewski and W. Domcke, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(00)00983-0 329, 130 (2000).
68. F. Fuke, R. Takasu, and F. Misaizu, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(94)01115-X 229, 597 (1994).
69. F. Fuke and R. Takasu, Bull. Chem. Soc. Jpn. BCSJA8 0009-2673 10.1246/bcsj.68.3309 68, 3309 (1995).
70. S. Nonose, T. Taguchi, F. W. Chen, S. Iwata, and K. Fuke, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp0145457 106, 5242 (2002).
71. C. Jouvet, C. Lardeux-Dedonder, and D. Solgadi, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(89)87233-1 156, 569 (1989).
72. C. Dedonder-Lardeux, C. Jouvet, M. Richardviard, and D. Solgadi, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.457929 92, 2828 (1990).
73. C. Jouvet, C. Lardeux-Dedonder, S. Martrenchard, and D. Solgadi, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.459949 94, 1759 (1991).
74. O. Christiansen, H. Koch, and P. Jorgensen, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(95)00841-Q 243, 409 (1995).
75. C. Hattig and F. Weigend, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1290013 113, 5154 (2000).
76. D. E. Woon and T. H. Dunning, Jr., J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.464303 98, 1358 (1993).
77. R. Ahlrichs, M. Bar, M. Haser, H. Horn, and C. Kolmel, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(89)85118-8 162, 165 (1989).
78. F. Weigend and M. Haser, Theor. Chem. Acc. TCACFW 1432-881X 10.1007/s002140050269 97, 331 (1997).
79. F. Weigend, M. Haser, H. Patzelt, and R. Ahlrichs, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(98)00862-8 294, 143 (1998).
80. C. Dedonder-Lardeux, D. Grosswasser, C. Jouvet, S. Martrenchard, and A. Teahu, Phys. Chem. Chem. Phys. PPCPFQ 1463-9076 10.1039/b104836h 3, 4316 (2001).
81. R. Knochenmuss, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(99) 00879-9 311, 439 (1999).
82. K. Daigoku, N. Miura, and K. Hashimoto, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/S0009-2614(01)00958-7 346, 81 (2001).
83. A. L. Sobolewski and W. Domcke, Chem. Phys. CMPHC2 0301-0104 10.1016/S0301-0104(00)00203-2 259, 181 (2000).
84. A. L. Sobolewski and W. G. Domcke, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp075803o 111, 11725 (2007).
85. N. Mikami, S. Sato, and M. Ishigaki, Chem. Phys. Lett. CHPLBC 0009-2614 10.1016/0009-2614(93)90066-A 202, 431 (1993).
86. M. Sodupe, A. Oliva, and J. Bertran, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp970571m 101, 9142 (1997).
87. H. T. Kim, R. J. Green, J. Qian, and S. L. Anderson, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.481146 112, 5717 (2000).
88. S. Re and Y. Osamura, J. Phys. Chem. A JPCAFH 1089-5639 10.1021/jp980468c 102, 3798 (1998).
89. G. Gŕgoire, M. Mons, I. Dimicoli, C. Dedonder-Lardeux, C. Jouvet, S. Martrenchard, and D. Solgadi, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.478029 110, 1521 (1999).
90. G. Köhler, G. Kittel, and N. Getoff, J. Photochem. 18, 19 (1982). 0047-2670