On the electronic spectra of small linear polyenes

Advances in Chemical Physics

Volumn 110, Issue , 1999, Pages 177-214

  McDiarmid, Ruth ^a  

^a NATIONAL INSTITUTE OF DIABETES AND DIGESTIVE AND KIDNEY DISEASES   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ELECTRONIC SPECTRUM; LINEAR POLYENES;

EID: 0000730476     PISSN: 00652385     EISSN: None     Source Type: Book Series    
DOI: None     Document Type: Article

References (98)

1. R. S. Mulliken, Phys. Rev. 41, 751 (1932).
2. Ethylene: J. Stark and P. Lipp, Z. Physik. Chem. 86, 36 (1913);
3. G. Scheibe and H. Grienseisen, Z. Physik. Chem. 25B, 52 (1934);
4. C. P. Snow and C. B. Allsopp, Trans. Faraday Soc. 30, 93 (1934).
5. Butadiene: E. P. Carr, L. W. Pickett, and H. Stucklen, Rev. Mod. Phys. 14, 260 (1942);
6. W. C. Price and A. D. Walsh, Proc. Roy. Soc. London 174A, 220 (1940).
7. For a review of early investigations of ethylene, see A. J. Merer and R. S. Mulliken, Chem. Rev. 69, 639 (1969);
8. R. S. Mulliken, J. Chem. Phys. 66, 2448 (1977).
9. See also M. B. Robin, Higher Excited States of Polyatomic Molecules, Vol. II, Academic, New York, 1975, Sect. IV.A; Vol. III, Sect. X.A.
10. R. S. Mulliken, J. Chem. Phys. 7, 121 (1939).
11. K. B. Wiberg, C. M. Hadad, J. B. Foresman, and W. A. Chupka, J. Phys. Chem. 96, 10756 (1992) and references cited therein.
12. R. Barrow, Introduction to Molecular Spectroscopy, McGraw-Hill, New York, 1962, p. 1.
13. See G. Herzberg, Molecular Spectra and Molecular Structure III: Electronic Spectra and Electronic Structure of Polyatomic Molecules, Nostrand, Princeton, 1966, pp. 181-183.
14. D. H. Levy, L. Wharton, and R. E. Smalley, in Chemical and Biochemical Applications of Lasers, Vol. II, C. B. Moore, Ed., Academic, New York, 1977, Chapter 1.
15. S. H. Lin, Y. Fujimura, H. J. Neusser, and E. W. Schlag, Multiphoton Spectroscopy of Molecules, Academic, New York, 1984.
16. J. I. Steinfield, Molecules and Radiation, Harper, New York, 1974, pp. 310-315.
17. W. M. McClain and R. A. Harris, in Excited States, Vol. 3, E. C. Lim, Ed., Academic, New York, 1977, pp. 2-56.
18. D. H. Parker, J. O. Berg, and M. A. El-Sayed, Chem. Phys. Lett. 56, 197 (1978).
19. A. Sabljic and R. McDiarmid, J. Chem. Phys. 84, 2062 (1986).
20. E. N. Lassettre, in Chemical Spectroscopy and Photochemistry in the Vacuum Ultraviolet, C. Sandorfy, P. J. Ausloss, and M. B. Robin, Eds., Reidel, Dordrecht, The Netherlands, 1974, pp. 43-74.
21. A. D. Walsh, J. Phys. Radium 15, 501 (1954);
22. M. B. Robin , Higher Excited States of Polyatomic Molecules, Vol. I, Academic, New York, 1974, p. 51.
23. R. G. Schmitt and R. K. Brehm, Applied Optics 5, 1111 (1966).
24. A. D. Walsh, J. Chem. Soc. 1953, 2325.
25. P. G. Wilkinson and R. S. Mulliken, J. Chem. Phys. 23, 1895 (1955).
26. R. McDiarmid and E. Charney, J. Chem. Phys. 47, 1517 (1967).
27. P. D. Foo and K. K. Innes, J. Chem. Phys. 60, 4582 (1974).
28. W. C. Price and W. T. Tutte, Proc. Roy. Soc. A174, 207 (1939).
29. R. McDiarmid, J. Phys. Chem. 84, 64 (1980).
30. A. J. Merer and L. Schoonveld, J. Chem. Phys. 48, 522 (1968);
31. Canad. J. Phys. 47, 1731 (1969).
32. P. G. Wilkinson, Canad. J. Phys. 34, 643 (1956).
33. D. F. Dance and I. C. Walker, J. Chem. Soc. Farad. II, 71, 1903 (1975).
34. D. G. Wilden and J. Comer, J. Phys. B: Atom. Molec. Phys. 13, 1009 (1980).
35. A. Gedanken, N. A. Kuebler, and M. B. Robin, J. Chem. Phys. 76, 46 (1982).
36. B. A. Williams and T. A. Cool, J. Chem. Phys. 94, 6358 (1991).
37. M. Brith-Lindner and S. D. Allen, Chem. Phys. Lett. 47, 32 (1977).
38. R. J. Sension and B. S. Hudson, J. Chem. Phys. 90, 1377 (1989).
39. P. A. Snyder, P. N. Schatz, and E. M. Rowe, Chem. Phys. Lett. 110, 508 (1984).
40. J. B. Foresman, M. Head-Gordon, J. A. Pople, and M. J. Frisch, J. Phys. Chem. 96, 135 (1992).
41. L. Serrano-Andres, M. Merchan, I. Nebot-Gil, R. Lindh, and B. O. Roos, J. Chem. Phys. 98, 3151 (1993).
42. U. Dinur, R. J. Hemley, and M. Karplus, J. Phys. Chem. 87, 924 (1983).
43. R. J. Hemley, J. I. Dawson, and V. Vaida, J. Chem. Phys. 78, 2915 (1983).
44. R. McDiarmid and A.-H Sheybani, J. Chem. Phys. 89, 1255 (1988).
45. F. Zerbetto and M. Z. Zgierski, Chem. Phys. Lett. 157, 515 (1989).
46. D. G. Leopold, R. D. Pendley, J. L. Roebber, R. J. Hemley, and V. Vaida, J. Chem. Phys. 81, 4218 (1984).
47. R. S. Mulliken, Reviews of Modern Physics 14, 265 (1942) and sequels.
48. See B. S. Hudson, B. E. Kohler, and K. Schulten in Excited States, Vol. 6, E. C. Lim, Ed., Academic, New York, 1982, Chapter 1;
49. and G. Orlandi, F. Zerbetto, and M. Z. Zgierski, Chem. Rev. 91, 867 (1991).
50. R. McDiarmid, Chem. Phys. Lett. 34, 130 (1975).
51. P. Johnson, J. Chem. Phys. 64, 4638 (1976).
52. J. O. Berg, D. H. Parker, and M. A. El-Sayed, J. Chem. Phys. 68, 566 (1978).
53. R. McDiarmid, J. Chem. Phys. 64, 514 (1976).
54. K. B. Wiberg, K. S. Peters, G. B. Ellison, and J. L. Dehmer, J. Chem. Phys. 66, 2224 (1977).
55. L. J. Rothberg, D. P. Gerrity, and V. Vaida, J. Chem. Phys. 73, 5508 (1980).
56. J. P. Doering, J. Chem. Phys. 70, 3902 (1979);
57. J. P. Doering and R. McDiarmid, J. Chem. Phys. 73, 3617 (1980);
58. J. Chem. Phys. 75, 2477 (1981).
59. B. D. Ranson, K. K. Innes, and R. McDiarmid, J. Chem. Phys. 68, 3615 (1978).
60. W. G. Mallard, J. H. Miller, and K.C. Smyth, J. Chem. Phys. 79, 5900 (1983);
61. P. H. Taylor, W. G. Mallard, and K.C. Smyth, J. Chem. Phys. 84, 1053 (1986).
62. K. B. Wiburg, C. M. Hadad, G. B. Ellison, and J. B. Foresman, J. Phys. Chem. 97, 13586 (1993).
63. W. C. Price and A. D. Welsh, Trans. Farad, Soc. 37, 106 (1941).
64. R. M. Gavin, Jr., S. Risenberg, and S. A. Rice, J. Chem. Phys. 58, 3160 (1973);
65. R. M. Gavin, Jr., and S. A. Rice, J. Chem. Phys. 60, 3231 (1974).
66. M. Beez, G. Bieri, H. Bock, and E. Heilbronner, Helvetica Chim. Acta 56, 1028 (1973).
67. A. Sabljic and R. McDiarmid, J. Chem. Phys. 82, 2559 (1985).
68. R. McDiarmid, A. Sabljic, and J. P. Doering, J. Am. Chem. Soc. 107, 826 (1985).
69. D. R. Cyr and C. C. Hayden, J. Chem. Phys. 104, 771 (1996).
70. X. Ci and A. B. Myers, J. Chem. Phys. 96, 6433 (1992).
71. W. J. Buma, B. E. Kohler, and K. Song, J. Chem. Phys. 92, 4622 (1990);
72. W. J. Buma, B. E. Kohler, and K. Song, J. Chem. Phys. 94, 6367 (1991).
73. H. Petek, A. J. Bell, R. L. Christensen, and K. Yoshihara, J. Chem. Phys. 96, 2412 (1992).
74. L. Serrano-Andres, B. O. Roos, and M. Merchan, Theoret. Chim. Acta 87, 387 (1994).
75. C. C. Hayden and D. W. Chandler, J. Phys. Chem. 99, 7897 (1995).
76. A. B. Myers and K. S. Pranata, J. Phys. Chem. 93, 5079 (1989).
77. D. H. Parker, S. J. Sheng, and M. A. El-Sayed, J. Chem. Phys. 65, 5534 (1976).
78. D. H. Parker, J. O. Berg, and M. A. El-Sayed, Chem. Phys. Lett. 56, 197 (1978).
79. M. A. C. Nascimento and W. A. Goodard, III, Chem. Phys. Lett. 60, 197 (1979);
80. Chem. Phys. 53, 265 (1980).
81. M. A. C. Nascimento, Can. J. Chem. 63, 1349 (1985).
82. (a) R. M. Gavin, Jr., C. Weisman, J. K. McVey, and S. A. Rice, J. Chem. Phys. 68, 522 (1978);
83. (b) D. G. Leopold, V. Vaida, and M. F. Granville, J. Chem. Phys. Ibid. 81, 4210 (1984).
84. L. A. Heimbrook, J. E. Kenny, B. E. Kohler, and G.W. Scott, J. Chem. Phys. 75, 4338 (1981);
85. L. A. Heimbrook, B. E. Kohler, and I. J. Levy, J. Chem. Phys. Ibid. 81, 1592 (1984).
86. H. Petek, A. J. Bell, Y. S. Choi, K. Yoshihara, B. A. Tounge, and R. L. Christensen, J. Chem. Phys. 98, 3777 (1993).
87. W. G. Bouwman, A. C. Jones, D. Phillips, P. Thibodeau, C. Friel, and R. L. Christensen, J. Phys. Chem. 94, 7429 (1990).
88. M. Merchan, L. Serrano-Andres, L. S. Slater, B. O. Roos, R. McDiarmid, and X. Xing, J. Phys. Chem., in press.
89. g absorption and emission bands of butadiene [75].
90. F. Zerbetto and M. Z. Zgierski, J. Chem. Phys. 93, 1235 (1990).
91. P. G. Szalay, A. Karpfen, and H. Lischka, Chem. Phys. 130, 219 (1989).
92. K. L. D'Amico, C. Manos, and R. Christensen, J. Am. Chem. Soc. 102, 1777 (1980).
93. u state of butadiene.
94. T. Fujii, A. Kamata, M. Shimizu, Y. Adachi, and S. Maeda, Chem. Phys. Letters 115, 369 (1985).
95. B. M. Pierce, J. A. Bennett, and R. R. Birge, J. Chem. Phys. 77, 6343 (1982).
96. L. Serrano-Andres, R. Lindh, B. O. Roos, and M. Merchan, J. Phys Chem. 97, 9360 (1993).
97. M. Aoyagi, Y. Osamura, and S. Iwata, J. Chem. Phys. 83, 1140 (1985).
98. K. B. Wiberg, P. R. Rablen, and M. Marquez, J. Am. Chem. Soc. 114, 8654 (1992).