Excited-state proton transfer of 1-[(dimethylamino)methyl]-2-naphthol in acetonitrile solvent: RISM-SCF and MRMP approach

Chemical Physics Letters

Volumn 386, Issue 4-6, 2004, Pages 414-418

  Yamazaki, Shohei ^a   Kato, Shigeki ^a  

^a KYOTO UNIVERSITY   (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

1 [(DIMETHYLAMINO)METHYL] 2 NAPHTHOL; ACETONITRILE; NAPHTHOL DERIVATIVE; SOLVENT; UNCLASSIFIED DRUG;

ARTICLE; CORRELATION ANALYSIS; PROTON TRANSPORT; SOLUTE; SOLVATION;

EID: 1442287329     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2004.01.090     Document Type: Article

References (18)

1. Douhal A., Lahmani F., Zewail A.H. Chem. Phys. 207:1996;477.
2. Tolbert L.M., Solntsev K.M. Acc. Chem. Res. 35:2002;19.
3. Tolbert L.M., Nesselroth S.M. J. Phys. Chem. 95:1991;10331.
4. Bisht P.B., Joshi G.C., Tripathi H.B., Pant D.D. Chem. Phys. Lett. 142:1987;291.
5. Wiechmann M., Port H., Frey W., Lärmer F., Elsässer T. J. Phys. Chem. 95:1991;1918.
6. Sobolewski A.L., Domcke W. Chem. Phys. 232:1998;257.
7. Kar T., Scheiner S., Čuma M. J. Chem. Phys. 111:1999;849.
8. Chaban G.M., Gordon M.S. J. Phys. Chem. A. 103:1999;185.
9. Casadesús R., Moreno M., Lluch J.M. Chem. Phys. 290:2003;319.
10. Ten-no S., Hirata F., Kato S. J. Chem. Phys. 100:1994;7443.
11. Sato H., Hirata F., Kato S. J. Chem. Phys. 105:1996;1546.
12. Hirao K. Chem. Phys. Lett. 190:1992;374.
13. Nakano H. J. Chem. Phys. 99:1993;7983.
14. Dunning T.H. Jr., Hay P.J. Schaefer III H.F. Methods of Electronic Structure Theory. 1977;1 Plenum, New York.
15. Jorgensen W.L., Briggs J.M. Mol. Phys. 63:1988;547.
16. Cornell W.D., Cieplak P., Bayly C.I., Gould I.R., Merz K.M. Jr., Ferguson D.M., Spellmeyer D.C., Fox T., Caldwell J.W., Kollman P.A. J. Am. Chem. Soc. 117:1995;5179.
17. Singer S.J., Chandler D. Mol. Phys. 55:1985;621.
18. Chandler D., Singh Y., Richardson D.M. J. Chem. Phys. 81:1984;1975.