Theoretical study of the association of glycine molecules on ionic crystals NaCl,KI, LiF in aqueous solution |
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| Authors: | B. Deprick-Côte J. Langlet J. Caillet J. Bergès E. Kassab R. Constanciel |
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| Affiliation: | (1) Laboratoire de Chimie Théorique, Case 52, Université de Provence, 3, Place Victor Hugo, F-13003 Marseille, France;(2) C.N.R.S., ER 06271, Laboratoire de Dynamique des Interactions Moléculaires, Université Pierre et Marie Curie, Paris VI, Tour 22, ler étage, 4, Place Jussieu, F-75252 Paris Cedex 05, France |
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| Abstract: | Summary The adsorption of glycine on different crystals (namely NaCl, KI, LiF) is studied in an isolated state and in water by methods of theoretical chemistry in view of determining the preferential adsorption sites, the modifications of adsorbing crystal properties, and the role played by the electronic structure of the adsorbed molecule, by the solvent and by the parametric concordance on various sites of the structure. |
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| Keywords: | Glycine adsorption NaCl KI LiF |
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