Real-space analysis of electronic excitations in free-base (H 2 P) and magnesium (MgP) porphins

Chemical Physics Letters

Volumn 297, Issue 5-6, 1998, Pages 357-364

  Tretiak, Sergei ^a   Chernyak, Vladimir ^a   Mukamel, Shaul ^a  

^a UNIVERSITY OF ROCHESTER   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001681868     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(98)01110-5     Document Type: Article

References (34)

1. H. Scheer, Chlorophylls, CRC Press, Boca Raton, FL, 1991.
2. Iron porphyrins, A.B.P. Lever (Ed.), Addison-Wesley Press, Reading, MA, 1983.
3. Porphyrins: excited states and dynamics, M. Gouterman, P.M. Rentzepis, K.D. Straub (Eds.), American Chemical Society, Washington, DC, 1986.
4. Weiss C., Kobayashi H., Gouterman M. J. Mol. Spectr. 16:1965;415.
5. Edwards W.D., Zerner M. Int. J. Quantum Chem. 23:1983;1407.
6. Rimington C., Mason S.F., Kennard O. Spectrochim. Acta. 12:1958;65.
7. Dupuis P., Roberge R., Sandorfy C. Chem. Phys. Lett. 75:1980;434.
8. Edwards L., Dolphin D.H., Gouterman M., Adler A.D. J. Mol. Spectroc. 38:1971;16.
9. Edwards L., Dolphin D.H., Gouterman M. J. Mol. Spectrosc. 35:1970;90.
10. Baker J.D., Zerner M.C. Chem. Phys. Lett. 175:1990;192.
11. Rawlings D.C., Davidson E.R., Gouterman M. Theoret. Chim. Acta. 61:1982;227.
12. D.C. Rawlings, E.R. Davidson, M. Gouterman, Int. J. Quantum Chem. 26 (1984) 237, 251.
13. Rawlings D.C., Gouterman M., Davidson E.R., Feller D. Int. J. Quantum Chem. 28:1985;773. 797, 823.
14. Nakatsuji H., Hasegawa J., Hada M. J. Chem. Phys. 104:1996;2321.
15. Gwaltney S.R., Bartlett R.J. J. Chem. Phys. 108:1998;6790.
16. Simpson W.T. J. Chem. Phys. 17:1949;1218.
17. Kuhn H. J. Chem. Phys. 17:1949;1198.
18. Gouterman M. J. Mol. Spectrosc. 6:1961;138.
19. Gouterman M., Wagniere G.H., Snyder L.C. J. Mol. Spectrosc. 11:1963;108.
20. Hasegawa J., Hada M., Nonoguchi M., Nakatsuji H. Chem. Phys. Lett. 250:1996;159.
21. Tretiak S., Chernyak V., Mukamel S. JACS. 119:1997;11408.
22. Tretiak S., Chernyak V., Mukamel S. J. Chem. Phys. 105:1996;8914.
23. Mukamel S., Tretiak S., Wagersreiter T., Chernyak V. Science. 277:1997;781.
24. Tretiak S., Chernyak V., Mukamel S. J. Phys. Chem. B. 102:1998;3310.
25. Kratky C., Dunitz J.D. Acta Crystallogr. B. 31:1975;1586.
26. Pople J.A., Segal G.A. J. Chem. Phys. 43:1965;S136.
27. Pople J.A., Beveridge D.L., Dobosh P. J. Chem. Phys. 47:1967;2026.
28. Ridley J., Zerner M.C. Theor. Chim. Acta. 32:1973;111.
29. Zerner M.C., Loew G.H., Kirchner R.F., Mueller-Westerhoff U.T. J. Am. Chem. Soc. 102:1980;589.
30. R. McWeeny, B.T. Sutcliffe, Methods of Molecular Quantum Mechanics, Academic Press, New York, 1976.
31. E.R. Davidson, Reduced Density Matrices in Quantum Chemistry, Academic Press, New York, 1976.
32. P. Ring, P. Schuck, The Nuclear Many-Body Problem, Springer, New York, 1980.
33. Milliken R.S. J. Chem. Phys. 23:1955;1833. 1841, 2338, 2343.
34. A. Szabo, N.S. Ostlund, Modern Quantum Chemistry: Introduction to Advanced Electronic Structure Theory, McGraw-Hill, New York, 1989.