Molecular dynamics study on the vibrational energy relaxation of O-D stretch of HOD in liquid H2O

Chemical Physics

Volumn 328, Issue 1-3, 2006, Pages 216-220

  Tian, Guocai ^a  

^a INSTITUTE OF CHEMISTRY   (China)

Author keywords

Fermi's golden rule; HOD; Liquid H2O; Molecular dynamics simulation; O D stretch fundamental; Quantum correction; Relaxation mechanism; Time correlation function; Vibrational energy relaxation

Indexed keywords

EID: 33748806557     PISSN: 03010104     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.chemphys.2006.06.029     Document Type: Article

References (38)

1. In: Fayer M.D. (Ed). Ultrafast Infrared and Raman Spectroscopy (2001), Marcel Dekker, New York
2. Rey R., Møller K.B., and Hynes J.T. Chem. Rev. 104 (2004) 1915
3. Nibbering E.T.J., and Elsaesser T. Chem. Rev. 104 (2004) 1887
4. In: Fourkas J.T. (Ed). Liquid Dynamics: Experiment, Simulation, and Theory (2002), American Chemical Society, Washington, DC
5. Nandi N., Bhattacharyya K., and Bagchi B. Chem. Rev. 100 (2000) 2013
6. Pal S.K., Peon J., Bagchi B., and Zewail A.H. J. Phys. Chem. B 106 (2002) 12376
7. In: Elsaesser T. (Ed). Ultrafast Hydrogen Bonding Dynamics and Proton Transfer Processes in the Condensed Phase (2002), Kluwer Academic Publishers, Dordrecht
8. Lock A.J., Woutersen S., and Bakker H.J. J. Phys. Chem. A 105 (2001) 1238
9. Lock A.J., and Bakker H.J. J. Chem. Phys. 117 (2002) 1708
10. Dlott D.D. Chem. Phys. 266 (2001) 149 and references therein
11. Pakoulev A., Wang Z., and Dlott D.D. Chem. Phys. Lett. 371 (2003) 594
12. Chesnoy J., and Gale G.M. Ann. Phys. Paris 9 (1984) 893
13. Oxtoby D.W. Annu. Rev. Phys. Chem. 32 (1981) 77
14. Owrutsky J.C., Raftery D., and Hochstrasser R.M. Annu. Rev. Phys. Chem. 45 (1994) 519
15. Oxtoby D.W. Adv. Chem. Phys. 47 (1981) 487
16. Terashima T., Shiga M., and Okazaki S. J. Chem. Phys. 114 (2001) 5663
17. Okazaki S. Adv. Chem. Phys. 118 (2001) 191 and references therein
18. Deng Y., Ladanyi B.M., and Stratt R.M. J. Chem. Phys. 117 (2002) 10752
19. Poulsen J.A., and Rossky P.J. J. Chem. Phys. 115 (2001) 8014
20. Rey R., and Hynes J.T. J. Chem. Phys. 104 (1996) 2356
21. Lawrence C.P., and Skinner J.L. J. Chem. Phys. 117 (2002) 5827
22. Lawrence C.P., and Skinner J.L. J. Chem. Phys. 119 (2003) 1623
23. Kropman M.F., Nienhuys H.K., Woutersen S., and Bakker H.J. J. Phys. Chem. A 105 (2001) 4622
24. Laenen R., Simeonidis K., and Laubereau A. J. Phys. Chem. B 106 (2002) 408
25. Steinel T., Asbury J.B., Zheng J.R., and Fayer M.D. J. Phys. Chem. A 108 (2004) 10957
26. Miller W.H. J. Chem. Phys. 53 (1970) 3578
27. Miller W.H. J. Phys. Chem. A 108 (2001) 2942
28. Egorov S.A., and Skinner J.L. Chem. Phys. Lett. 293 (1999) 469
29. Egorov S.A., Everitt K.F., and Skinner J.L. J. Phys. Chem. A 103 (1999) 9494
30. Skinner J.L., and Park K. J. Phys. Chem. B 105 (2001) 6716
31. Yardley J.T. Introduction to Molecular Energy Transfer (1980), Academic, New York
32. Sceats M.G., and Rice S.A. J. Chem. Phys. 71 (1979) 973
33. Berendsen H.J.C., Grigera J.R., and Straatsma T.P. J. Phys. Chem. 91 (1987) 6269
34. Toukan K., and Rahman A. Phys. Rev. B 31 (1985) 2643
35. Smith W., and Forester T. J. Mol. Graphics 14 (1996) 136
36. Allen M.P., and Tildesley D.J. Computer Simulation of Liquids (1987), Clarendon, Oxford
37. Press W.H., Flannory B.P., Teukolsky S.A., and Vetterling W.T. Numerical Recipes (1986), Cambridge University Press, Cambridge
38. Marti{dotless}́ J., Padró J.A., and Guàrdia E. Mol. Sim. 11 (1993) 321