c CCLRC
Bibliography
[22] G.M., M., M.E., T., D.J., T., and M.L., K., 1996, Molec. Phys., 87, 1117.
[23] Vessal, B., 1994, J. Non-Cryst. Solids, 177, 103.
[24] Smith, W., Greaves, G. N., and Gillan, M. J., 1995, J. Chem. Phys., 103, 3091.
[25] Allinger, N. L., Y. Y. H. L. J.-H., 1998, J. Am. Chem. Soc., 111, 8551.
[26] Smith, W., 1993, CCP5 Information Quarterly, 39, 14.
[27] Ryckaert, J. P., and Bellemans, A., 1975, Chem. Phys. Lett., 30, 123.
[28] Schmidt, M. E., S. S., and A., R. S. Molecular dynamics studies of langmuir monolayers of
f(cf
2
)
1
1cooh. volume 104, page 2101, 1996.
[29] Clarke, J. H. R., Smith, W., and Woodcock, L. V., 1986, J. Chem. Phys., 84, 2290.
[30] Finnis, M. W., and Sinclair, J. E., 1984, Philos. Mag. A, 50, 45.
[31] Eastwood, J. W., Hockney, R. W., and Lawrence, D. N., 1980, Comput. Phys. Commun., 19,
215.
[32] Neumann, M., 1985, J. Chem. Phys., 82, 5663.
[33] Fuchs, K., 1935, Proc. R. Soc., A, 151, 585.
[34] Essmann, U., Perera, L., Berkowitz, M. L., Darden, T., Lee, H., and Pedersen, L. G., 1995, J.
Chem. Phys., 103, 8577.
[35] Fincham, D., and Mitchell, P. J., 1993, J. Phys. Condens. Matter, 5, 1031.
[36] Lindan, P. J. D., and Gillan, M. J., 1993, J. Phys. Condens. Matter, 5, 1019.
[37] shewchuk, J. R. August 4, 1994, An Introduction to the Conjugate Gradient Method Without
the Agonizing Pain, Edition 1 1/4. School of Computer Science, Carnegie Mellon University,
Pittsburgh, PA 15213.
[38] Ryckaert, J. P., Ciccotti, G., and Berendsen, H. J. C., 1977, J. Comput. Phys., 23, 327.
[39] McCammon, J. A., and Harvey, S. C. 1987, Dynamics of Proteins and Nucleic Acids. Cam-
bridge: University Press.
[40] Melchionna, S., Ciccotti, G., and Holian, B. L., 1993, Molec. Phys., 78, 533.
[41] G.M., M., D.J., T., and M.L., K., 1994, J. Chem. Phys., 101, 4177.
[42] Melchionna, S., and Cozzini, S., 1998, University of Rome.
[43] Hockney, R. W., and Eastwood, J. W. 1981, Computer Simulation Using Particles. McGraw-
Hill International.
[44] Smith, W., 1992, Comput. Phys. Commun., 67, 392.
[45] Smith, W., and Fincham, D., 1993, Molecular Simulation, 10, 67.
[46] Bush, I. T., 2000, Daresbury Laboratory.
185