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Solution Structure of NaNO3 in Water: Diffraction and Molecular Dynamics Simulation Study

Megyes, Tünde ; Bálint, Szabolcs ; Peter, Emanuel ; Grósz, Tamás ; Bakó, Imre ; Krienke, Hartmut ; Bellissent-Funel, Marie-Claire



Abstract

The structure of a series of aqueous sodium nitrate solutions (1.9-7.6 M) was studied using a combination of experimental and theoretical methods. The results obtained from diffraction (X-ray, neutron) and molecular dynamics simulation have been compared and the capabilities and limitations of the methods in describing solution structure are discussed. For the solutions studied, diffraction ...

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