The hydration of ions in aqueous solution: reverse Monte Carlo analysis of neutron diffraction data
M A Howe; M A Howe; Div. of Chem. Technol., Argonne Nat. Lab., IL, USA
Журнал:
Journal of Physics: Condensed Matter
Дата:
1990-01-22
Аннотация:
The reverse Monte Carlo (RMC) technique has been used to model 2m NiCl<sub>2</sub> aqueous solution using as input the results of several neutron diffraction experiments where the technique of isotopic substitution has been used. It is shown that RMC provides a valuable means of analysing such data and that information about the hydration shells, for instance the orientations of water molecules within them, can be obtained.
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