Hydration and Water Exchange of Zinc(II) Ions. Application of Density Functional Theory
- 1 August 1997
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of the American Chemical Society
- Vol. 119 (33), 7843-7850
- https://doi.org/10.1021/ja970483f
Abstract
No abstract availableKeywords
This publication has 25 references indexed in Scilit:
- Monte Carlo Simulations of Zn(II) in Water Including Three-Body EffectsThe Journal of Physical Chemistry, 1996
- Structure of the Transition States and Intermediates Formed in the Water-Exchange of Metal Hexaaqua Ions of the First Transition SeriesJournal of the American Chemical Society, 1996
- An application of the reaction field theory to hydrated metal cations in the framework of the MNDO, AM1, and PM3 methodsJournal of Computational Chemistry, 1995
- Theoretical study of water-exchange reactions for the divalent ions of the first transition periodThe Journal of Physical Chemistry, 1993
- Recovering the concept of the hydrated ion for modeling ionic solutions: a Monte Carlo study of zinc(2+) in waterThe Journal of Physical Chemistry, 1993
- Conformational dependence of .beta. hyperfine coupling constants in the nitroxide seriesThe Journal of Physical Chemistry, 1992
- Metal substitution and the active site of carbonic anhydraseJournal of the American Chemical Society, 1992
- Detection of methylene (~X 3B1) radicals by 3 + 1 resonance-enhanced multiphoton ionization spectroscopyThe Journal of Physical Chemistry, 1992
- Theoretical calculations on the structure of the hexahydrated divalent zinc, cadmium and mercury ionsChemical Physics Letters, 1990
- Zinc complexes of water, hydroxide, and ammoniaThe Journal of Physical Chemistry, 1989