Contact Information roys@ornl.gov 865.574.6142 orcid.org/0000-0001-6991-8205 Key Links https://scholar.google.com/citations?user=1V6ACgUAAAAJ&hl=en Related Organizations Physical Sciences Directorate Chemical Sciences Division Separations and Polymer Chemistry Section Carbon and Composites Group Santanu Roy R&D Staff Member Download CV All Publications Transferable Deep Learning Potential Reveals Intermediate-Range Ordering Effects in LiF–NaF–ZrF4 Molten Salt... Nucleation Rate Theory for Coordination Number: Elucidating Water-Mediated Formation of a Zigzag Na2SO4 Morphology... Complete Description of the LaCl3–NaCl Melt Structure and the Concept of a Spacer Salt That Causes Structural Heterogeneity... A Holistic Approach for Elucidating Local Structure, Dynamics, and Speciation in Molten Salts with High Structural Disorder... X-ray scattering reveals ion clustering of dilute chromium species in molten chloride medium... Unraveling Local Structure of Molten Salts via X-ray Scattering, Raman Spectroscopy, and Ab Initio Molecular Dynamics... Comparison of fixed charge and polarizable models for predicting the structural, thermodynamic, and transport properties of m... A Molecular-Scale Approach to Rare-Earth Beneficiation: Thinking Small to Avoid Large Losses... Structure and Dynamics of the Molten Alkali-Chloride Salts from an X-ray, Simulation, and Rate Theory Perspective... Molecular Recognition at Mineral Interfaces: Implications for the Beneficiation of Rare Earth Ores... Temperature Dependence of Short and Intermediate Range Order in Molten MgCl 2 and Its Mixture with KCl... Hydration Structure and Water Exchange Kinetics at Xenotime–water Interfaces: Implications for Rare Earth Minerals Separati... Connections between the Speciation and Solubility of Ni(II) and Co(II) in Molten ZnCl2... Elucidating Ionic Correlations Beyond Simple Charge Alternation in Molten MgCl 2 –KCl Mixtures... Enhancing selectivity of cation exchange with anion receptors... Influence of a Pre‐organized N‐Donor Group on the Coordination of Trivalent Actinides and Lanthanides by an Aminopolycarb... Finding Order in the Disordered Hydration Shell of Rapidly Exchanging Water Molecules around the Heaviest Alkali Cs + and Fr ... Mineral–Water Interface Structure of Xenotime (YPO4) {100}... Influence of a Heterocyclic Nitrogen-Donor Group on the Coordination of Trivalent Actinides and Lanthanides by Aminopolycarbo...
