Layerwise decomposition of water dynamics in reverse micelles: A simulation study of two-dimensional infrared spectrum

Journal of Chemical Physics

Volumn 139, Issue 14, 2013, Pages

  Biswas, Rajib ^a   Furtado, Jonathan ^a   Bagchi, Biman ^a  

^a INDIAN INSTITUTE OF SCIENCE   (India)

Author keywords

[No Author keywords available]

Indexed keywords

DECOMPOSITION OF WATERS; FREQUENCY FLUCTUATION; INHOMOGENEOUS BROADENING; NEGATIVE CROSS-CORRELATION; SPATIAL DECOMPOSITIONS; SPECTRAL DECOMPOSITION; SURFACE WATER MOLECULES; TWODIMENSIONAL INFRARED SPECTROSCOPY (2D-IR);

EXPERIMENTS; INFRARED SPECTROSCOPY; LAKES; METAL IONS; MICELLES; MOLECULES; TWO DIMENSIONAL;

DYNAMICS;

EID: 84903369198     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.4824446     Document Type: Article

References (76)

1. B. Bagchi, Water in Biological and Chemical Processes (Cambridge University Press, 2013).
2. B. Bagchi, Chem. Rev. 105 (9), 3197-3219 (2005). 10.1021/cr020661+
3. M. D. Fayer and N. E. Levinger, Annu. Rev. Anal. Chem. 3 (1), 89-107 (2010). 10.1146/annurev-anchem-070109-103410
4. N. Nandi and B. Bagchi, J. Phys. Chem. B 101 (50), 10954-10961 (1997). 10.1021/jp971879g
5. N. Nandi, K. Bhattacharyya, and B. Bagchi, Chem. Rev. 100 (6), 2013-2046 (2000). 10.1021/cr980127v
6. K. Bhattacharyya, Chem. Commun. 2008, 2848-2857.
7. S. K. Pal and A. H. Zewail, Chem. Rev. 104 (4), 2099-2124 (2004). 10.1021/cr020689l
8. S. Habuchi, H.-B. Kim, and N. Kitamura, Anal. Chem. 73 (2), 366-372 (2001). 10.1021/ac0007276
9. R. Sutton and G. Sposito, J. Colloid Interface Sci. 237 (2), 174-184 (2001). 10.1006/jcis.2000.7416
10. N. E. Levinger, Science 298 (5599), 1722-1723 (2002). 10.1126/science.1079322
11. K. Bhattacharyya and B. Bagchi, J. Phys. Chem. A 104 (46), 10603-10613 (2000). 10.1021/jp001878f
12. N. Sarkar, K. Das, A. Datta, S. Das, and K. Bhattacharyya, J. Phys. Chem. 100 (25), 10523-10527 (1996). 10.1021/jp953658l
13. T. Telgmann and U. Kaatze, J. Phys. Chem. B 101 (39), 7758-7765 (1997). 10.1021/jp970747k
14. A. Datta, D. Mandal, S. K. Pal, S. Das, and K. Bhattacharyya, J. Mol. Liq. 77 (1-3), 121-129 (1998). 10.1016/S0167-7322(98)00072-5
15. M. R. Harpham, B. M. Ladanyi, N. E. Levinger, and K. W. Herwig, J. Chem. Phys. 121 (16), 7855-7868 (2004). 10.1063/1.1792592
16. E. E. Fenn, D. B. Wong, C. H. Giammanco, and M. D. Fayer, J. Phys. Chem. B 115 (40), 11658-11670 (2011). 10.1021/jp206903k
17. D. E. Moilanen, E. E. Fenn, D. Wong, and M. D. Fayer, J. Chem. Phys. 131 (1), 014704 (2009). 10.1063/1.3159779
18. I. R. Piletic, D. E. Moilanen, D. B. Spry, N. E. Levinger, and M. D. Fayer, J. Phys. Chem. A 110 (15), 4985-4999 (2006). 10.1021/jp061065c
19. I. R. Piletic, H.-S. Tan, and M. D. Fayer, J. Phys. Chem. B 109 (45), 21273-21284 (2005). 10.1021/jp051837p
20. H. Tan, I. R. Piletic, and M. D. Fayer, J. Chem. Phys. 122 (17), 174501 (2005). 10.1063/1.1883605
21. H.-S. Tan, I. R. Piletic, R. E. Riter, N. E. Levinger, and M. D. Fayer, Phys. Rev. Lett. 94 (5), 057405 (2005). 10.1103/PhysRevLett.94.057405
22. D. E. Rosenfeld and C. A. Schmuttenmaer, J. Phys. Chem. B 115 (5), 1021-1031 (2011). 10.1021/jp109599q
23. J. Chowdhary and B. M. Ladanyi, J. Phys. Chem. B 113 (45), 15029-15039 (2009). 10.1021/jp906915q
24. J. Chowdhary and B. M. Ladanyi, J. Phys. Chem. A 115 (23), 6306-6316 (2011). 10.1021/jp201866t
25. S. Senapati and M. L. Berkowitz, J. Chem. Phys. 118 (4), 1937 (2003). 10.1063/1.1531585
26. B. Guchhait, R. Biswas, and P. K. Ghorai, J. Phys. Chem. B 117 (12), 3345-3361 (2013). 10.1021/jp310285k
27. B. M. Ladanyi, Curr. Opin. Colloid Interface Sci. 18 (1), 15-25 (2013). 10.1016/j.cocis.2012.12.002
28. A. Malani, K. G. Ayappa, and S. Murad, J. Phys. Chem. B 113 (42), 13825-13839 (2009). 10.1021/jp902562v
29. I. A. Beta, H. Bohlig, and B. Hunger, Phys. Chem. Chem. Phys. 6 (8), 1975-1981 (2004). 10.1039/b313234j
30. N. Nandi and B. Bagchi, J. Phys. Chem. 100 (33), 13914-13919 (1996). 10.1021/jp960134s
31. S. Vajda, R. Jimenez, S. J. Rosenthal, V. Fidler, G. R. Fleming, and E. W. Castner, J. Chem. Soc., Faraday Trans. 91 (5), 867-873 (1995). 10.1039/ft9959100867
32. D. Laage, G. Stirnemann, and J. T. Hynes, J. Phys. Chem. B 113 (8), 2428-2435 (2009). 10.1021/jp809521t
33. H. J. Bakker, M. F. Kropman, A. W. Omta, and S. Woutersen, Phys. Scr. 69, C14 (2004). 10.1238/Physica.Regular.069a00C14
34. D. E. Moilanen, D. Wong, D. E. Rosenfeld, E. E. Fenn, and M. D. Fayer, Proc. Natl. Acad. Sci. U.S.A. 106 (2), 375-380 (2009). 10.1073/pnas.0811489106
35. R. Biswas and B. Bagchi, J. Chem. Phys. 133 (8), 084509 (2010). 10.1063/1.3474948
36. J. Faeder and B. M. Ladanyi, J. Phys. Chem. B 104 (5), 1033-1046 (2000). 10.1021/jp993076u
37. S. Senapati and A. Chandra, J. Phys. Chem. B 105 (22), 5106-5109 (2001). 10.1021/jp011058i
38. B. Bagchi and B. Jana, Chem. Soc. Rev. 39 (6), 1936-1954 (2010). 10.1039/b902048a
39. E. E. Fenn, D. B. Wong, and M. D. Fayer, J. Chem. Phys. 134 (5), 054512 (2011). 10.1063/1.3532542
40. D. E. Moilanen, E. E. Fenn, D. Wong, and M. D. Fayer, J. Phys. Chem. B 113 (25), 8560-8568 (2009). 10.1021/jp902004r
41. R. Biswas, T. Chakraborti, B. Bagchi, and K. G. Ayappa, J. Chem. Phys. 137 (1), 014515 (2012). 10.1063/1.4732095
42. S. Abel, F. Sterpone, S. Bandyopadhyay, and M. Marchi, J. Phys. Chem. B 108 (50), 19458-19466 (2004). 10.1021/jp047138e
43. A. V. Martinez, L. Dominguez, E. Malolepsza, A. Moser, Z. Ziegler, and J. E. Straub, J. Phys. Chem. B 117 (24), 7345-7351 (2013).
44. P. Grigolini and M. Maestro, Chem. Phys. Lett. 127 (3), 248-252 (1986). 10.1016/0009-2614(86)80267-6
45. P.-O. Quist and B. Halle, J. Chem. Soc., Faraday Trans. 1 84 (4), 1033-1046 (1988). 10.1039/f19888401033
46. K. Bhattacharyya, Acc. Chem. Res. 36 (2), 95-101 (2003). 10.1021/ar020067m
47. S. Woutersen, U. Emmerichs, and H. J. Bakker, Science 278 (5338), 658-660 (1997). 10.1126/science.278.5338.658
48. J. B. Asbury, T. Steinel, K. Kwak, S. A. Corcelli, C. P. Lawrence, J. L. Skinner, and M. D. Fayer, J. Chem. Phys. 121 (24), 12431-12446 (2004). 10.1063/1.1818107
49. J. Stenger, D. Madsen, P. Hamm, E. T. J. Nibbering, and T. Elsaesser, J. Phys. Chem. A 106 (10), 2341-2350 (2002). 10.1021/jp013104k
50. C. J. Fecko, J. D. Eaves, J. J. Loparo, A. Tokmakoff, and P. L. Geissler, Science 301 (5640), 1698-1702 (2003). 10.1126/science.1087251
51. C. P. Lawrence and J. L. Skinner, J. Chem. Phys. 118 (1), 264-272 (2003). 10.1063/1.1525802
52. S. A. Corcelli, C. P. Lawrence, J. B. Asbury, T. Steinel, M. D. Fayer, and J. L. Skinner, J. Chem. Phys. 121 (18), 8897-8900 (2004). 10.1063/1.1803532
53. K. B. Møller, R. Rey, and J. T. Hynes, J. Phys. Chem. A 108 (7), 1275-1289 (2004). 10.1021/jp035935r
54. R. Rey, K. B. Møller, and J. T. Hynes, Chem. Rev. 104 (4), 1915-1928 (2004). 10.1021/cr020675f
55. Y. L. A. Rezus and H. J. Bakker, J. Chem. Phys. 123 (11), 114502 (2005). 10.1063/1.2009729
56. D. E. Moilanen, E. E. Fenn, Y.-S. Lin, J. L. Skinner, B. Bagchi, and M. D. Fayer, Proc. Natl. Acad. Sci. U.S.A. 105 (14), 5295-5300 (2008). 10.1073/pnas.0801554105
57. D. Laage and J. T. Hynes, Science 311 (5762), 832-835 (2006). 10.1126/science.1122154
58. J. L. F. Abascal and C. Vega, J. Chem. Phys. 123 (23), 234505 (2005). 10.1063/1.2121687
59. K. J. Schweighofer, U. Essmann, and M. Berkowitz, J. Phys. Chem. B 101 (19), 3793-3799 (1997). 10.1021/jp963460g
60. L. Martínez, R. Andrade, E. G. Birgin, and J. M. Martínez, J. Comput. Chem. 30 (13), 2157-2164 (2009). 10.1002/jcc.21224
61. B. Hess, C. Kutzner, D. van der Spoel, and E. Lindahl, J. Chem. Theory Comput. 4 (3), 435-447 (2008). 10.1021/ct700301q
62. S. Nose, J. Chem. Phys. 81 (1), 511-519 (1984). 10.1063/1.447334
63. W. G. Hoover, Phys. Rev. A 31 (3), 1695-1697 (1985). 10.1103/PhysRevA.31. 1695
64. M. Parrinello and A. Rahman, J. Appl. Phys. 52 (12), 7182-7190 (1981). 10.1063/1.328693
65. P. Hamm and M. Zanni, Concepts and Methods of 2D Infrared Spectroscopy (Cambridge University Press, 2011).
66. S. Mukamel, Principles of Nonlinear Optical Spectroscopy, Oxford Series on Optical and Imaging Science Vol. 6 (Oxford University Press, 1999).
67. D. W. Oxtoby, D. Levesque, and J. J. Weis, J. Chem. Phys. 68 (12), 5528-5533 (1978). 10.1063/1.435680
68. R. H. Tipping and J. F. Ogilvie, J. Chem. Phys. 79 (6), 2537-2540 (1983). 10.1063/1.446165
69. See supplementary material at http://dx.doi.org/10.1063/1.4824446 E-JCPSA6-139-035339 for quantum mechanical verification of Morse oscillator description of O-H stretching, 2D IR spectra using different waiting times, fitting of probability distribution of O-H frequencies, and reorientational time-correlation functions of the unit vector along the dipole moment of the water molecules in different layers including bulk water.
70. G. Onori and A. Santucci, J. Phys. Chem. 97 (20), 5430-5434 (1993). 10.1021/j100122a040
71. N. V. Nucci and J. M. Vanderkooi, J. Phys. Chem. B 109 (39), 18301-18309 (2005). 10.1021/jp051068+
72. H. Hauser, G. Haering, A. Pande, and P. L. Luisi, J. Phys. Chem. 93 (23), 7869-7876 (1989). 10.1021/j100360a029
73. S. Roychowdhury and B. Bagchi, Chem. Phys. 343 (1), 76-82 (2008). 10.1016/j.chemphys.2007.10.028
74. M. C. C. Ribeiro, Phys. Chem. Chem. Phys. 6 (4), 771-774 (2004). 10.1039/b314144f
75. B. Jana, S. Pal, and B. Bagchi, J. Phys. Chem. B 112 (30), 9112-9117 (2008). 10.1021/jp800998w
76. B. Bagchi, Molecular Relaxation in Liquids (Oxford University Press, 2012). Technology