Evans, W.A.B. and Ojeda, C.J. (1992) Nemd Q-Kick Response Method for the Evaluation of the Dynamic Liquid Structure Factor. In: Schröer, W., ed. 1991 Annual Meeting Of The British Radiofrequency Spectroscopy Group : Molecular Motion And Structure In Disordered Condensed Matter. Elsevier, 54. Elsevier Science Bv, Amsterdam, Netherlands pp. 321-332.
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A new non-equilibrium molecular dynamics (NEMD) technique to obtain the Van-Hove dynamic liquid structure factor, S(q,omega), is presented. The technique depends on evaluating the system's density response to a density-coupling, time-impulsive and space-sinusoidal field of wave vector,q, by the perturbation-and-difference method. Results pertaining to a Lennard-Jones fluid model of liquid Argon are presented as an illustration.
|Item Type:||Conference or workshop item (Other)|
|Additional information:||This item is a proceeding paper.|
|Subjects:||Q Science > QD Chemistry|
|Divisions:||Faculties > Science Technology and Medical Studies > School of Biosciences|
|Depositing User:||P. Ogbuji|
|Date Deposited:||05 Sep 2009 17:34|
|Last Modified:||28 May 2012 14:35|
|Resource URI:||http://kar.kent.ac.uk/id/eprint/22565 (The current URI for this page, for reference purposes)|
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