Distribution patterns and controllable transport of water inside and outside charged single-walled carbon nanotubes

Journal of Chemical Physics

Volumn 122, Issue 8, 2005, Pages

  Huang, Boda ^a   Xia, Yueyuan ^a   Zhao, Mingwen ^a   Li, Feng ^a   Liu, Xiangdong ^a   Ji, Yanju ^a   Song, Chen ^a  

^a SHANDONG UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

FORCE FIELD; POLAR MOLECULES; SINGLE-WALLED CARBON NANOTUBES (SWNT); TEMPLATE EFFECTS;

CHARGED PARTICLES; COMPUTER SIMULATION; MOLECULAR DYNAMICS; MOLECULES; PARAMETER ESTIMATION; PRISMS; TRANSPORT PROPERTIES; WATER;

CARBON NANOTUBES;

EID: 22944460772     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1851506     Document Type: Article

References (36)

1. S. Iijima, Nature (London) 354, 56 (1991).
2. P. M. Ajayan, Chem. Rev. (Washington, D.C.) (Washington, D. C.) 99, 1787 (1999).
3. G.D. R. Saito and M.S. Dresselhaus, Physical Properties of Carbon Nanotubes (Imperial College Press, London, 1998).
4. M. Dresselhaus, G. Dresselhaus, P. Eklund et al., Phys. World 11, 33 (1998).
5. U. D. Venkateswaran, A. M. Rao, E. Richter et al., Phys. Rev. B 59, 10928 (1999).
6. D. Kahn and J. P. Lu, Phys. Rev. B 60, 6535 (1999).
7. Z. Yao, H. W. C. Postma, L. Balents et al., Nature (London) 402, 273 (1999).
8. D. Ugarte, T. Stockli, J. M. Bonard et al., Physica A 67, 101 (1998).
9. M. S. P. Sansom and P. C. Biggin, Nature (London) 414, 156 (2001).
10. M. C. Gordillo and J. Marti, Chem. Phys. Lett. 329, 341 (2000).
11. G. Hummer, J. C. Rasaiah, and J. P. Noworyta, Nature (London) 414, 188 (2001).
12. A. Berezhkovskii and G. Hummer, Phys. Rev. Lett. 89, 064503 (2002).
13. C. Dellago, M. M. Naor, and G. Hummer, Phys. Rev. Lett. 90, 105902 (2003).
14. M. C. Gordillo and J. Marti, Chem. Phys. Lett. 341, 250 (2001).
15. M. C. Gordillo and J. Marti, Phys. Rev. B 67, 205425 (2003).
16. F. Franks, Water: A Comprehensive Treatise (Plenum, New York, 1972).
17. P. Keblinski, S. K. Nayak, P. Zapol et al., Phys. Rev. Lett. 89, 255503 (2002).
18. P. M. Ajayan, V. Ravikumar, and J. C. Charlier, Phys. Rev. Lett. 81, 1437 (1998).
19. P. Kim and C. M. Lieber, Science 286, 2148 (1999).
20. R. H. Baughman, C. X. Cui, A. A. Zakhidov et al., Science 284, 1340 (1999).
21. R. Qiao and N. R. Aluru, Nano Lett. 3, 1013 (2003).
22. L. Sun and R. M. Crooks, J. Am. Chem. Soc. 122, 12340 (2000).
23. S. A. Miller and C. R. Martin, J. Electroanal. Chem. 522, 66 (2002).
24. T. Chou, Phys. Rev. Lett. 80, 85 (1998).
25. B. R. Brooks, R. E. Bruccoleri, B. D. Olafson et al., J. Comput. Chem. 4, 187 (1983).
26. E. Neria, S. Fischer, and M. Karplus, J. Chem. Phys. 105, 1902 (1996).
27. T. Werder, J. H. Walther, R. L. Jaffe et al., J. Phys. Chem. 107, 1345 (2003).
28. W. H. Noon, K. D. Ausman, R. E. Smalley et al., Chem. Phys. Lett. 355, 445 (2002).
29. J. M. Soler, E. Artacho, J. D. Gale et al., J. Phys.: Condens. Matter 14, 2745 (2002).
30. N. Troullier and J. L. Martins, Phys. Rev. B 43, 1993 (1991).
31. J. P. Perdew and A. Zunger, Phys. Rev. B 23, 5048 (1993).
32. D. Beeman, J. Comput. Phys. 20, 130 (1976).
33. J. H. Walther, R. Jaffe, T. Halicioglu et al., J. Phys. Chem. 105, 9980 (2001).
34. K. Alexander I, J.-M. Zanotti, C.-K. Loong et al., Phys. Rev. Lett. 93, 035503 (2004).
35. K. Koga, G. T. Gao, H. Tanaka et al., Physica A 314, 462 (2002).
36. R.L. Andrew, Molecular Modelling, Principles and Applications (Addison Wesley Longman Limited, 1996), p. 211.