Data for: Uranium separation from acid mine drainage using anionic resins - An experimental/theoretical investigation of its chemical speciation and the interaction mechanism
Published: 8 December 2018| Version 1 | DOI: 10.17632/n99chz5kvg.1
DFT calculations using different chemical models for the interaction between uranyl sulfate chemical species and the chemical models of the resins. Cartesian coordinates and vibrational frequencies are provided.
Density Functional Theory