Molecular simulation study of water mobility in aerosol-OT reverse micelles

Journal of Physical Chemistry A

Volumn 115, Issue 23, 2011, Pages 6306-6316

  Chowdhary, Janamejaya ^a   Ladanyi, Branka M ^b  

^a Department of Environmental and Radiological Health Sciences   (United States)

^b UNIVERSITY OF CHICAGO   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AEROSOL OT; BIEXPONENTIAL DECAY; CHARGED SPECIES; CONFINED GEOMETRIES; CONFINEMENT MODEL; DIFFERENT SIZES; DIPOLE REORIENTATIONS; FREE DIFFUSION; GAUSSIANS; INTERFACIAL REGION; INTERFACIAL SHELLS; ION-DIPOLE INTERACTIONS; LEGENDRE POLYNOMIALS; MEAN SQUARED DISPLACEMENT; MOLECULAR DYNAMICS SIMULATIONS; MOLECULAR ORIENTATIONAL; MOLECULAR SIMULATIONS; ORIENTATIONAL RELAXATION; REVERSE MICELLES; SIMULATION RESULT; SINGLE-MOLECULE; SODIUM COUNTERIONS; SULFOSUCCINATE; TIME CORRELATIONS; TRANSLATIONAL DIFFUSION; WATER MOBILITY; WATER MOLECULE; WATER POOLS;

ATMOSPHERIC AEROSOLS; DIFFUSION; JOINTS (STRUCTURAL COMPONENTS); LAKES; MICELLES; MOLECULAR DYNAMICS; MOLECULES; PARAFFINS; SPHERES; SURFACE ACTIVE AGENTS; VECTORS;

COMPUTER SIMULATION;

DOCUSATE SODIUM; WATER;

AEROSOL; ARTICLE; CHEMISTRY; MICELLE; MOLECULAR DYNAMICS;

AEROSOLS; DIOCTYL SULFOSUCCINIC ACID; MICELLES; MOLECULAR DYNAMICS SIMULATION; WATER;

EID: 79960019077     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp201866t     Document Type: Article

References (98)

1. Zulauf, M.; Eicke, H. F. J. Phys. Chem. 1979, 83, 480.
2. Pileni, M. P. J. Phys. Chem. 1993, 97, 6961.
3. Pileni, M. P.; Ninham, B. W.; Gulik-Krzywicki, T.; Tanori, J.; Lisiecki, I.; Filankembo, A. Adv. Mater. 1999, 11, 1358.
4. Eastoe, J.; Hollamby, M. J.; Hudson, L. Adv. Colloid Interface Sci. 2006, 128, 5.
5. Luisi, P. L.; Giomini, M.; Pileni, M. P.; Robinson, B. H. Biochim. Biophys. Acta 1988, 947, 209.
6. Jones,M. N.;Chapman,D. Micelles, Monolayers, and Biomembranes; Wiley: New York, 1995.
7. Holmberg, K. Curr. Opin. Colloid Interface Sci. 2003, 8, 187.
8. Levinger, N. E.; Swafford, L. A. Annu. Rev. Phys. Chem. 2009, 60, 385.
9. 2O; Lynden-Bell, R. M., Conwey-Morris, S., Barrow, J. D., Finney, J. L., Harper, C., Eds.; CRC Press: Boca Raton, FL, 2010.
10. Fayer, M. D.; Levinger, N. E. Analysis of Water in Confined Geometries and at Interfaces. In Annual Review of Analytical Chemistry; Annual Reviews: Palo Alto, CA, 2010; Vol. 3; p 89.
11. Wong, M.; Thomas, J. K.; Nowak, T. J. Am. Chem. Soc. 1977, 99, 4730.
12. Carlström, G.; Halle, B. Langmuir 1988, 4, 1346.
13. Carlström, G.; Halle, B. J. Phys. Chem. 1989, 93, 3287.
14. Onori, G.; Santucci, A. J. Phys. Chem. 1993, 97, 5430.
15. Freda, M.; Onori, G.; Paciaroni, A.; Santucci, A. J. Mol. Liq. 2002, 101, 55.
16. Fioretto, D.; Freda, M.; Mannaioli, S.; Onori, G.; Santucci, A. J. Phys. Chem. B 1999, 103, 2631.
17. Piletic, I. R.; Tan, H. S.; Fayer, M. D. J. Phys. Chem. B 2005, 109, 21273.
18. Tan, H. S.; Piletic, I. R.; Fayer, M. D. J. Chem. Phys. 2005, 122, 174501.
19. Tan, H. S.; Piletic, I. R.; Riter, R. E.; Levinger, N. E.; Fayer, M. D. Phys. Rev. Lett. 2005, 94, 057405.
20. Piletic, I. R.; Moilanen, D. E.; Spry, D. B.; Levinger, N. E.; Fayer, M. D. J. Phys. Chem. A 2006, 110, 10369.
21. Moilanen, D. E.; Levinger, N. E.; Spry, D. B.; Fayer, M. D. J. Am. Chem. Soc. 2007, 129, 14311.
22. Park, S.; Moilanen, D. E.; Fayer, M. D. J. Phys. Chem. B 2008, 112, 5279.
23. Moilanen, D. E.; Fenn, E. E.; Wong, D.; Fayer, M. D. J. Chem. Phys. 2009, 131, 014704.
24. Moilanen, D. E.; Fenn, E. E.; Wong, D.; Fayer, M. D. J. Phys. Chem. B 2009, 113, 8560.
25. Dokter, A. M.; Woutersen, S.; Bakker, H. J. Proc. Natl. Acad. Sci. U.S.A. 2006, 103, 15355.
26. Dokter, A. M.; Woutersen, S.; Bakker, H. J. J. Chem. Phys. 2007, 126, 124507.
27. Cringus, D.; Lindner, J.; Milder, M. T. W.; Pshenichnikov, M. S.; Vöhringer, P.; Wiersma, D. A. Chem. Phys. Lett. 2005, 408, 162.
28. D'Angelo, M.; Fioretto, D.; Onori, G.; Palmieri, L.; Santucci, A. Phys. Rev. E 1996, 54, 993.
29. Fioretto, D.; Freda, M.; Onori, G.; Santucci, A. J. Phys. Chem. B 1999, 103, 8216.
30. Freda, M.; Onori, G.; Paciaroni, A.; Santucci, A. J. Non-Cryst. Solids 2002, 307, 874.
31. Venables, D. S.; Huang, K.; Schmuttenmaer, C. A. J. Phys. Chem. B 2001, 105, 9132.
32. Harpham, M. R.; Ladanyi, B. M.; Levinger, N. E.; Herwig, K. W. J. Chem. Phys. 2004, 121, 7855.
33. Riter, R. E.; Undiks, E. P.; Levinger, N. E. J. Am. Chem. Soc. 1998, 120, 6062.
34. Riter, R. E.; Willard, D. M.; Levinger, N. E. J. Phys. Chem. B 1998, 102, 2705.
35. Willard, D. M.; Riter, R. E.; Levinger, N. E. J. Am. Chem. Soc. 1998, 120, 4151.
36. Zhong, Q.; Baronavski, A. P.; Owrutsky, J. C. J. Chem. Phys. 2003, 119, 9171.
37. Sando, G. M.; Dahl, K.; Owrutsky, J. C. J. Phys. Chem. A 2004, 108, 11209.
38. Sando, G. M.; Dahl, K.; Owrutsky, J. C. J. Phys. Chem. B 2005, 109, 4084.
39. Owrutsky, J. C.; Pomfret, M. B.; Barton, D. J.; Kidwell, D. A. J. Chem. Phys. 2008, 129, 10.
40. Maitra, A. Colloids Surf. 1988, 32, 149.
41. Zhang, J.; Bright, F. V. J. Phys. Chem. 1991, 95, 7900.
42. Wittouck, N.; Negri, R. M.; Ameloot, M.; Deschryver, F. C. J. Am. Chem. Soc. 1994, 116, 10601.
43. Dutt, G. B. J. Phys. Chem. B 2008, 112, 7220.
44. Kenez, P. H.; Carlstroem, G.; Furo, I.; Halle, B. J. Phys. Chem. 1992, 96, 9524.
45. Brown, D.; Clarke, J. H. R. J. Phys. Chem. 1988, 92, 2881.
46. Senapati, S.; Berkowitz, M. L. J. Chem. Phys. 2003, 118, 1937.
47. Senapati, S.; Berkowitz, M. L. J. Phys. Chem. B 2003, 107, 12906.
48. Senapati, S.; Berkowitz, M. L. J. Phys. Chem. A 2004, 108, 9768.
49. Linse, P. J. Chem. Phys. 1989, 90, 4992.
50. Linse, P.; Halle, B. Mol. Phys. 1989, 67, 537.
51. Tobias, D. J.; Klein, M. L. J. Phys. Chem. 1996, 100, 6637.
52. Griffiths, J. A.; Heyes, D. M. Langmuir 1996, 12, 2418.
53. Faeder, J.; Ladanyi, B. M. J. Phys. Chem. B 2000, 104, 1033.
54. Faeder, J.; Albert, M. V.; Ladanyi, B. M. Langmuir 2003, 19, 2514.
55. Mudzhikova, G. V.; Brodskaya, E. N. Colloid J. 2006, 68, 729.
56. Mudzhikova, G. V.; Brodskaya, E. N. Colloid J. 2006, 68, 738.
57. Mudzhikova, G. V.; Brodskaya, E. N. Colloid J. 2009, 71, 803.
58. Abel, S.; Sterpone, F.; Bandyopadhyay, S.; Marchi, M. J. Phys. Chem. B 2004, 108, 19458.
59. Chowdhary, J.; Ladanyi, B. M. J. Phys. Chem. B 2009, 113, 15029.
60. Pieniazek, P. A.; Lin, Y. S.; Chowdhary, J.; Ladanyi, B. M.; Skinner, J. L. J. Phys. Chem. B 2009, 113, 15017.
61. Rosenfeld, D. E.; Schmuttenmaer, C. A. J. Phys. Chem. B 2006, 110, 14304.
62. Abel, S.; Waks, M.; Marchi, M.; Urbach, W. Langmuir 2006, 22, 9112.
63. Nave, S.; Eastoe, J.; Heenan, R. K.; Steytler, D.; Grillo, I. Langmuir 2000, 16, 8741.
64. De, T.; Maitra, A. Adv. Colloid Interface Sci. 1995, 59, 95.
65. Nave, S.; Eastoe, J.; Penfold, J. Langmuir 2000, 16, 8733.
66. Boyd, J. E.; Briskman, A.; Colvin, V. L.; Mittleman, D. M. Phys. Rev. Lett. 2001, 87, 147401.
67. Freda, M.; Onori, G.; Paciaroni, A.; Santucci, A. Chem. Phys. Lett. 2001, 348, 311.
68. Boyd, J. E.; Briskman, A.; Sayes, C. M.; Mittleman, D.; Colvin, V. J. Phys. Chem. B 2002, 106, 6346.
69. Kinugasa, T.; Kondo, A.; Nishimura, S.; Miyauchi, Y.; Nishii, Y.; Watanabe, K.; Takeuchi, H. Colloids Surf., A 2002, 204, 193.
70. Freda, M.; Onori, G.; Paciaroni, A.; Santucci, A. Phys. Rev. E 2003, 68, 021406.
71. Harpham, M. R.; Ladanyi, B. M.; Levinger, N. E. J. Phys. Chem. B 2005, 109, 16891.
72. Faeder, J.; Ladanyi, B. M. J. Phys. Chem. B 2005, 109, 6732.
73. Thompson, W. H. J. Chem. Phys. 2004, 120, 8125.
74. Li, S. M.; Thompson, W. H. J. Phys. Chem. B 2005, 109, 4941.
75. Thompson, W. H. J. Phys. Chem. B 2005, 109, 18201.
76. Neuman, C. H. J. Chem. Phys. 1974, 60, 4508.
77. Volino, F.; Dianoux, A. J. Mol. Phys. 1980, 41, 271.
78. Volino, F.; Perrin, J. C.; Lyonnard, S. J. Phys. Chem. B 2006, 110, 11217.
79. Allen, M. P.; Tildesley, D. J. Computer Simulation of Liquids; Oxford: New York, 1987.
80. Berendsen, H. J. C.; Postma, J. P. M.; Vangunsteren, W. F.; Dinola, A.; Haak, J. R. J. Chem. Phys. 1984, 81, 3684.
81. Berendsen, H. J. C.; Grigera, J. R.; Straatsma, T. P. J. Phys. Chem. 1987, 91, 6269.
82. Martin, M. G.; Siepmann, J. I. J. Phys. Chem. B 1999, 103, 4508.
83. Kamath, G.; Robinson, J.; Potoff, J. J. Fluid Phase Equilib. 2006, 240, 46.
84. Schlenkrich, M.; Brickmann, J.; Mackerell, A. D., Jr.; Karplus, M. An empirical potential energy function for phospholipids: criteria for parameter optimization and applications. In Biological Membranes: A Molecular Perspective from Computation and Experiment; Merz, K. M., Jr., Roux, B., Eds.; Birkhaeuser: Darmstadt, Germany, 1996; p 31.
85. Schweighofer, K. J.; Essmann, U.; Berkowitz, M. J. Phys. Chem. B 1997, 101, 3793.
86. Handbook of Mathematical Functions; Abramowitz, M.; Stegun, I. A., Eds.; Dover: New York, 1965.
87. Eicke, H. F.; Rehak, J. Helv. Chim. Acta 1976, 59, 2883.
88. Pinnick, E. R.; Erramilli, S.; Wang, F. Mol. Phys. 2010, 108, 2027.
89. Hummer, G. New J. Phys. 2005, 7, 34.
90. Mittal, J.; Truskett, T. M.; Errington, J. R.; Hummer, G. Phys. Rev. Lett. 2008, 100, 145901.
91. McHale, J. L. Molecular Spectroscopy; Prentice Hall: Upper Saddle River, NJ, 1999.
92. Moilanen, D. E.; Fenn, E. E.; Wong, D.; Fayer, M. D. J. Am. Chem. Soc. 2009, 131, 8318.
93. Svishchev, I. M.; Kusalik, P. G. J. Phys. Chem. 1994, 98, 728.
94. Ropp, J.; Lawrence, C.; Farrar, T. C.; Skinner, J. L. J. Am. Chem. Soc. 2001, 123, 8047.
95. Berne, B. J.; Pecora, R. Dynamic Light Scattering: with Applications to Chemistry, Biology, and Physics; Wiley-Interscience: New York, 1975.
96. Lynden-Bell, R. M.; Steele, W. A. J. Phys. Chem. 1984, 88, 6514.
97. Laage, D.; Hynes, J. T. Science 2006, 311, 832.
98. Zhou, G. W.; Li, G. Z.; Chen, W. J. Langmuir 2002, 18, 4566.