Computational Tools and Techniques in Designing Ligands for the Selective Separation of Actinide and Lanthanide: A Review
C Ebenezer, RV Solomon - Comments on Inorganic Chemistry, 2024 - Taylor & Francis
The development of density functional theory (DFT) has significantly enhanced the use of
computational chemistry as a tool in the design and development of ligands for the …
computational chemistry as a tool in the design and development of ligands for the …
Hydrogen-Bond-Assisted Adsorption of Nitric Oxide on Various Metal-Loaded ZSM-5 Zeolites
Understanding the characteristics of nitric oxide (NO) adsorption on metal-loaded zeolites is
a prerequisite for developing efficient catalysts for NO abatement reactions. In this study, we …
a prerequisite for developing efficient catalysts for NO abatement reactions. In this study, we …
Role of sulphur and oxygen in phosphine ligands in the extraction process of Am3+ over Eu3+ ions in water medium–A theoretical study
C Ebenezer, RV Solomon - Journal of Molecular Liquids, 2023 - Elsevier
Spent nuclear fuel management, particularly the separation of minor actinides, is critical to
the continued growth of the nuclear industry and to address the global energy crisis …
the continued growth of the nuclear industry and to address the global energy crisis …
Preorganization of N, O-hybrid phosphine oxide chelators for effective extraction of trivalent Am/Eu ions–a computational study
C Ebenezer, RV Solomon - New Journal of Chemistry, 2022 - pubs.rsc.org
N, O-Hybrid phosphine oxide ligands with N-heterocyclic cores are advanced extractants for
extracting actinides over lanthanides. However, the challenging task in designing an …
extracting actinides over lanthanides. However, the challenging task in designing an …