Please use this identifier to cite or link to this item: http://scholarbank.nus.edu.sg/handle/10635/93971
Title: How strong is the Ag+-ligand bond?
Authors: Ma, N.L. 
Issue Date: 27-Nov-1998
Source: Ma, N.L. (1998-11-27). How strong is the Ag+-ligand bond?. Chemical Physics Letters 297 (3-4) : 230-238. ScholarBank@NUS Repository.
Abstract: A computationally efficient method for calculating the affinity of the silver ion for C-, H-, N-, O- and S-containing ligands is proposed. The silver affinities of 18 ligands and the geometries of these complexes are reported. By comparing with experimental data, the root-mean-square error of this method is found to be 8 kJ mol-1. Our results suggest that even though the interaction between Ag+ and the ligands studied is predominantly electrostatic in nature, covalent interaction is important in determining the relative ligand affinity and geometry of the complexes. © 1998 Elsevier Science B.V. All rights reserved.
Source Title: Chemical Physics Letters
URI: http://scholarbank.nus.edu.sg/handle/10635/93971
ISSN: 00092614
Appears in Collections:Staff Publications

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