The structure of tributyl phosphate solutions: Nitric acid, uranium (VI), and zirconium (IV)

Baldwin, AG; Servis, MJ; Yang, Y; Bridges, NJ; Wu, DT; Shafer, JC

HERO ID

4305001

Reference Type

Journal Article

Year

2017

HERO ID 4305001
In Press No
Year 2017
Title The structure of tributyl phosphate solutions: Nitric acid, uranium (VI), and zirconium (IV)
Authors Baldwin, AG; Servis, MJ; Yang, Y; Bridges, NJ; Wu, DT; Shafer, JC
Journal Journal of Molecular Liquids
Volume 246
Page Numbers 225-235
Abstract Diffusion, rheology, and small angle neutron scattering (SANS) data for organic phase 30 v/v %tributyl phosphate (TBP) samples containing varying amounts of water, nitric acid, and uranium or zirconium nitrate were interpreted from a colloidal perspective to give information on the types of structures formed by TBP under different conditions. Taken as a whole, the results of the different analyses were contradictory, suggesting that these samples should be treated as molecular solutions rather than colloids. This conclusion is supported by molecular dynamics (MD) simulations showing the existence of small, molecular aggregates in TBP samples containing water and nitric acid. Interpretation of TBP and nitric acid diffusion measurements from a molecular perspective suggest that nitric acid and metal species formed are consistent with the stoichiometric solvates that have traditionally been considered to exist in solution. (C) 2017 Elsevier B.V. All rights reserved.
Doi 10.1016/j.molliq.2017.09.032
Wosid WOS:000415771100029
Is Certified Translation No
Dupe Override No
Is Public Yes
Keyword Solvent extraction; Tributyl phosphate; Pulsed-field gradients; Diffusion; Small angle neutron scattering; Rheology