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Study of silver mercaptide nanocluster formation in cystein-silver solution by atomistic molecular dynamics simulation

Komarov, V. and Khizhnyak, S. and Ovchinnikov, M. and Pakhomov, P. (2010) Study of silver mercaptide nanocluster formation in cystein-silver solution by atomistic molecular dynamics simulation. Nanotechnologies in Russia, 5 (3). pp. 165-176.

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Official URL: http://dx.doi.org/10.1134/S1995078010030031

Abstract

The formation of nanosized silver mercaptide aggregates in a cysteine-silver solution (CSS) at the early stage of gelation was studied by atomistic molecular dynamics simulation. Low-molecular-weight ions NO3−, Ag+, and H3O+ in the solution were taken into account in an explicit form by the designed model. The structure and UV absorption spectra of resultant complexes of silver mercaptide (SM) with silver ions were studied by ZINDO/1 quantum chemistry.

Item Type:Article
ID Code:9189
Deposited By:Prof. Alexey Ivanov
Deposited On:13 May 2010 12:53
Last Modified:13 May 2010 13:19

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