Abstract
A theoretical study of the nitric oxide anion solvated by one and two molecules of water is presented. Calculated values of vertical detachment energies, adiabatic electron affinities and anion—single solvent dissociation energies agree well with experimental data. The study indicates that the excess negative charge is localized on the nitric oxide portion of the cluster and that this sub-ion is solvated by neutral water molecules. The determined structures of the NO − (H 2O) and NO − (H 2O) 2 complexes are presented.
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