Ions at the air/water interface

Journal of Physical Chemistry B

Volumn 106, Issue 25, 2002, Pages 6361-6373

  Jungwirth, Pavel ^a   Tobias, Douglas J ^b  

^a J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY   (Czech Republic)

^b UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

QUANTUM CHEMISTRY;

AIR; ATMOSPHERIC AEROSOLS; ATMOSPHERIC CHEMISTRY; ELECTROLYTES; INTERFACES (MATERIALS); NEGATIVE IONS; QUANTUM THEORY; SOLUTIONS; WATER;

MOLECULAR DYNAMICS;

EID: 0037183043     PISSN: 10895647     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp020242g     Document Type: Article

References (112)

1. Adam, N.K. The Physics and Chemistry of Surfaces; Oxford University Press: London, 1941.
2. Bikerman, J.J. Surface Chemistry: Theory and Applications; Academic Press: New York, 1958.
3. Chattoraj, D.K.; Birdi, K.S. Adsorption and the Gibbs Surface Excess; Plenum: New York, 1984.
4. Randles, J.E.B. Phys. Chem. Liq. 1977, 7, 107.
5. Gibbs, J.W. The Collected Works of J.W. Gibbs; Longmans: Green, New York, 1931; Vol 1.
6. Onsager, L.; Samaras, N.N.T. J. Chem. Phys. 1934, 2, 528.
7. Benjamin, I. J. Chem. Phys. 1991, 95, 3698.
8. Wilson, M.A.; Pohorille, A. J. Chem. Phys. 1991, 95, 6005.
9. Xantheas, S.S. J. Phys. Chem. 1996, 100, 9703.
10. Choi, J.H.; Kuwata, K.T.; Cao, Y.B.; Okumura, M. J. Phys. Chem. A 1998, 102, 503.
11. Ayotte, P.; Weddle, G.H.; Kim, J.; Johnson, M.A. J. Am. Chem. Soc. 1998, 120, 12361.
12. Ayotte, P.; Weddle, G.H.; Kim, J.; Johnson, M.A. Chem. Phys. 1998, 239, 485.
13. Ayotte, P.; Bailey, C.G.; Weddle, G.H.; Johnson, M.A. J. Phys. Chem. A 1998, 102, 3067.
14. Cabarcos, O.M.; Weinheimer, C.J.; Lisy, J.M.; Xantheas, S.S. J. Chem. Phys. 1999, 110, 5.
15. Ayotte, P.; Weddle, G.H.; Johnson, M.A. J. Chem. Phys. 1999, 110, 7129.
16. Ayotte, P.; Nielsen, S.B.; Weddle, G.H.; Johnson, M.A.; Xantheas, S.S. J. Phys. Chem. A 1999, 103, 10665.
17. Dorsett, H.E.; Watts, R.O.; Xantheas, S.S. J. Phys. Chem. A 1999, 103, 3351.
18. Wright, N.J.; Gerber, R.B. J. Chem. Phys. 2000, 112, 2598.
19. Schenter, G.K.; Garrett, B.C.; Voth, G.A. J. Chem. Phys. 2000, 113, 5171.
20. Perera, L.; Berkowitz, M.L. J. Chem. Phys. 1991, 95, 1954.
21. Perera, L.; Berkowitz, M.L. J. Chem. Phys. 1992, 96, 8288.
22. Perera, L.; Berkowitz, M.L. J. Chem. Phys. 1993, 99, 4222.
23. Perera, L.; Berkowitz, M.L. J. Chem. Phys. 1993, 100, 3085.
24. Sremaniak, L.S.; Perera, L.; Berkowitz, M.L. Chem. Phys. Lett. 1994, 218, 377.
25. Yeh, I.C.; Perera, L.; Berkowitz, M.L. Chem. Phys. Lett. 1997, 264, 31.
26. Dang, L.X.; Garrett, B.C. J. Chem. Phys. 1993, 99, 2972.
27. Dang, L.X.; Smith, D.E. J. Chem. Phys. 1993, 99, 6950.
28. Dang, L.X. J. Chem. Phys. 1999, 110, 1526.
29. Stuart, S.J.; Berne, B.J. J. Phys. Chem. 1996, 100, 11934.
30. Stuart, S.J.; Berne, B.J. J. Phys. Chem. A 1999, 103, 10300.
31. Peslherbe, G.H.; Ladanyi, B.M.; Hynes, J.T. Chem. Phys. 2000, 258, 201.
32. Markovich, G.; Giniger, R.; Levin, M.; Cheshnovsky, O. J. Chem. Phys. 1991, 95, 9416.
33. Markovich, G.; Pollack, S.; Giniger, R.; Cheshnovsky, O. In Reaction Dynamics in Clusters and Condensed Phases; Jortner, J., Ed.; Kluwer: Amsterdam, 1994; p 13.
34. Markovich, G.; Pollack, S.; Giniger, R.; Cheshnovsky, O. J. Chem. Phys. 1994, 101, 9344.
35. Gora, R.W.; Roszak, S.; Leszczynski, J. Chem. Phys. Lett. 2000, 325, 7.
36. Tobias, D.J.; Jungwirth, P.; Parrinello, M. J. Chem. Phys. 2001, 114, 7036.
37. Jungwirth, P.; Tobias, D.J. J. Phys. Chem. A, 2002, 106, 379.
38. Schlegel, H.B.; Millam, J.M.; Iyengar, S.S.; Voth, G.A.; Daniels, A.D.; Scuseria, G.E.; Frisch, M.J. J. Chem. Phys. 2001, 114, 9758.
39. Iyengar, S.S.; Schlegel, H.B.; Millam, J.M.; Voth, G.A.; Scuseria, G.E.; Frisch, M.J. J. Chem. Phys. 2001, 115, 10291.
40. Brdarski, S. Ph.D. Thesis, Lund University, Lund, 1999.
41. Hu, J.H.; Shi, Q.; Davidovits, P.; Worsnop, D.R.; Zahniser, M.S.; Kolb, C.E. J. Phys. Chem. 1995, 99, 8768.
42. Knipping, E.M.; Lakin, M.J.; Foster, K.L.; Jungwirth, P.; Tobias, D.J.; Gerber, R.B.; Dabdub, D.; Finlayson-Pitts, B.J. Science 2000, 288 301.
43. Ghosal, S.; Shbeeb, A.; Hemminger, J.C. Geophys. Res. Lett. 2000, 27, 1879.
44. Spicer, C.W.; Chapman, E.G.; Finlayson-Pitts, B.J.; Plastridge, R.A.; Hubbe, J.M.; Fast, J.D.; Berkowitz, C.M. Nature 1998, 394, 353.
45. Oum, K.W.; Lakin, M.J.; DeHaan, D.O.; Brauers, T.; Finlayson-Pitts, B.J. Science 1998, 279, 74.
46. Hirokawa, J.; Onaka, K.; Kajii, Y.; Akimoto, H. Geophys. Res. Lett. 1998, 25, 2449.
47. Finlayson-Pitts, B.J.; Hemminger, J.C. J. Phys. Chem. A 2000, 104, 11463.
48. Von Glasow, R.; Sander, R. Geophys. Res. Lett. 2001, 28, 247.
49. Andreae, M.O.; Crutzen, P.J. Science 1997, 276, 1052.
50. Sander, R.; Rudich, Y.; Von Glasow, R.; Crutzen, P.J. Geophys. Res. Lett. 1999, 26, 2857.
51. Ravishankara, A.R. Science 1997, 276, 1058.
52. Magi, L.; Schweitzer, F.; Pallares, C.; Cherif, S.; Mirabel, P.; George, C. J. Phys. Chem. A 1997, 101, 4943.
53. Foster, K.L.; Plastridge, R.A.; Bottenheim, J.W.; Shepson, P.B.; Finlayson-Pitts, B.J.; Spicer, C.W. Science 2001, 291, 471.
54. Oum, K.W.; Lakin, M.J.; Finlayson-Pitts, B.J. Geophys. Res. Lett. 1998, 25, 3923.
55. Koop, T.; Kapilashrami, A.; Molina, L.T.; Molina, M.J. J. Geophys. Res. 2000, 105, 26393.
56. Sander, R.; Crutzen, P.J. J. Geophys. Res. 1996, 101, 9121.
57. Franck, J.; Schiebe, G.Z. Phys. Chem. 1928, 139, 22.
58. Kloepfer, J.A.; Vilchitz, V.H.; Lenchenkov, V.A.; Bradforth, S.E. Chem. Phys. Lett. 1998, 298, 120.
59. Kloepfer, J.A.; Vilchitz, V.H.; Lenchenkov, V.A.; Germaine, A.C.; Bradforth, S.E. J. Chem. Phys. 2000, 113, 6288.
60. Vilchitz, V.H.; Kloepfer, J.A.; Germaine, A.C.; Lenchenkov, V.A.; Bradforth, S.E. J. Phys. Chem. A 2001, 105, 1711.
61. Sheu, W.-S.; Rossky, P.J. J. Phys. Chem. 1996, 100, 1295.
62. Serxner, D.; Dessent, C.E.H.; Johnson, M.A. J. Chem. Phys. 1996, 105, 7231.
63. Lehr, L.; Zanni, M.T.; Frischkorn, C.; Weinkauf, R.; Neumark, D.M. Science 1999, 284, 635.
64. Majumdar, D.; Kim, J.; Kim, K.S. J. Chem. Phys. 2000, 112, 101.
65. Kim, J.; Lee, H.M.; Suh, S.B.; Majumdar, D.; Kim, K.S. J. Chem. Phys. 2000, 113, 5259.
66. Chen, H.-Y.; Sheu, W.-S. J. Am. Chem. Soc. 2000, 122, 7534.
67. Chen, H.-Y.; Sheu, W.-S. Chem. Phys. Lett. 2001, 335, 475.
68. Waterland, M.; Myers-Kelley, A. J. Phys. Chem. A 2001, 105, 8385.
69. Vila, F.; Jordan, K.D. J. Phys. Chem. A 2002, 106, 1391.
70. Bradforth, S.E.; Jungwirth, P. J. Phys. Chem. A 2002, 106, 1286.
71. Waller, I.M.; Kitsopoulos, T.N.; Neumark, D.M. J. Phys. Chem. 1990, 94, 2240.
72. Gantefor, G.; Cox, D.M.; Kaldor, A. J. Chem. Phys. 1990, 94, 854.
73. Muller-Detlefs, K.; Schlag, E.W. Annu. Rev. Phys. Chem. 1991, 42, 109.
74. Drechsler, G.; Baessmannn, C.; Boesl, U.; Schlag, E.W. J. Mol. Spectrosc. 1995, 348, 337.
75. Baessmannn, C.; Boesl, U.; Yang, D.; Drechsler, G.; Schlag, E.W. Int. J. Mass Spectrosc. Ion Proc. 1996, 159, 153.
76. Roeselova, M.; Jacoby, G.; Kaldor, U.; Jungwirth, P. Chem. Phys. Lett. 1998, 293, 309.
77. Roeselova, M.; Kaldor, U.; Jungwirth, P. J. Phys. Chem. A 2000, 104, 6523.
78. Jungwirth, P. J. Phys. Chem. A 2000, 104, 145.
79. Caldwell, J.; Dang, L.X.; Kollman, P.A. J. Am. Chem. Soc. 1990, 112, 9144.
80. Markovich, G.; Perera, L.; Berkowitz, M.L.; Cheshnovsky, O. J. Chem. Phys. 1996, 105, 2675.
81. Coker, H. J. Phys. Chem. 1976, 80, 2078.
82. Pyper, N.C.; Pike, C.G.; Edwards, P.P. Mol. Phys. 1992, 76, 353.
83. Jungwirth, P.; Tobias, D.J. J. Phys. Chem. B 2001, 105, 10468.
84. Jungwirth, P.; Tobias, D.J. J. Phys. Chem. B 2000, 104, 7702.
85. Essmann, U.; Perera, L.; Berkowitz, M.L.; Darden, T.; Pedersen, L.G. J. Chem. Phys. 1995, 103, 8577.
86. Car, R.; Parrinello, M. Phys. Rev. Lett. 1985, 55, 2471.
87. Kohn, W.; Sham, L. Phys. Rev. 1965, 140, 1133.
88. Troullier, N.; Martins, J. Phys. Rev. B 1991, 43, 1993.
89. Ramaniah, L.M.; Bernasconi, M.; Parrinello, M. J. Chem. Phys. 1998, 109, 6839.
90. Ramaniah,L.M.; Bernasconi,M.; Parrinello,M.J. Chem. Phys. 1999, 111, 1587.
91. Silvestrelli, P.L.; Parrinello, M. J. Chem. Phys. 1999, 111, 3572.
92. Becke, A.D. Phys. Rev. A 1988, 38, 3098.
93. Lee, C.; Yang, W.; Parr, R.C. Phys. Rev. B 1988, 37, 785.
94. Silvestrelli, P.L.; Marzari, N.; Vanderbilt, D.; Parrinello, M. Solid State Commun. 1998, 107, 7.
95. Berghold, G.; Mundy, C.J.; Romero, A.H.; Hutter, J.; Parrinello, M. J. Chem. Phys. 2000, 61, 10040.
96. Gregoire, G.; Mons, M.; Dedonder-Lardeux, C.; Jouvet C. Eur. Phys. J. D 1998, 1, 5.
97. Makov, G.; Nitzan, A. J. Chem. Phys. 1992, 96, 2965.
98. Petersen, C.P.; Gordon, M.S. J. Phys. Chem. A 1999, 103, 4162.
99. Bandyopadhyay, P.; Yoshikawa, A.; Gordon, M.S. In preparation.
100. Lee, B.; Richards, F.M. J. Mol. Biol. 1971, 55, 379.
101. Dang, L.X.; Chang, T.M. J. Phys. Chem. A 2002, 106, 235.
102. Wingenter, O.W.; Blake, D.R.; Blake, N.J.; Sive, B.C.; Rowland, F.S. J. Geophys. Res. 1999, 104, 21819.
103. Griffiths, F.B.; Bates, T.S.; Quinn, P.K.; Clementson, L.A.; Parslow, J.S. J. Geophys. Res. 1999, 104, 21649.
104. Boudries, H.; Bottenheim, J.W. Geophys: Res. Lett. 2000, 27, 517.
105. Ramacher, B.; Rudolph, J.; Koppmann, R. J. Geophys. Res. 1999, 104, 3633.
106. Aryia, P.A.; Jobson, B.T.; Sander, R.; Niki, H.; Harris, G.W.; Hopper, J.F.; Anlauf, K.G. J. Geophys. Res. 1998, 103, 13.
107. Watanabe, I.; Takahashi, N.; Tanida, H. Chem: Phys. Lett. 1998, 287, 714.
108. Kohno, J.; Mafune, F.; Kondow, T. J. Phys. Chem. A 2001, 105, 5990.
109. Boesl, U. Private communication.
110. Schnitzer, C.; Baldelli, S.; Shultz, M.J. J. Phys. Chem. B 2000, 104, 585.
111. Richmond, G.L. Annu. Rev. Phys. Chem. 2001, 52, 357.
112. Morita, A.; Hynes, J.T. Chem. Phys. 2000, 258, 201.