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 …
Heterocyclic Ligands with Different N/O Donor Modes for Am (III)/Eu (III) Separation: A Theoretical Perspective
Excellent “CHON” compatible ligands based on a heterocyclic skeleton for the separation of
trivalent actinides [An (III)] from lanthanides [Ln (III)] have been widely explored, the aim …
trivalent actinides [An (III)] from lanthanides [Ln (III)] have been widely explored, the aim …
Enhanced Am/Eu separation ability of disulfonated diamide N-heterocyclic ligands by adjusting N-, O-donor affinity: A theoretical comparative study
PW Huang, CZ Wang, QY Wu, JH Lan, ZF Chai… - Separation and …, 2023 - Elsevier
Separation of minor actinides (MAs) from lanthanides (Ln) is a vital and challenging stage in
advanced nuclear waste treatment. Development of water-soluble back-extraction ligand is …
advanced nuclear waste treatment. Development of water-soluble back-extraction ligand is …
Unraveling complexation and separation of novel asymmetric uranyl-5-methoxy-2-(4-methoxy-6'-(quinazolin-2-yl)-[2, 2'-bipyridin]-6-yl) quinazoline to chiral fungicides …
CM Xiao, MJ Ma, XL Xiao, LF Liao… - Separation Science and …, 2023 - Taylor & Francis
Chiral fungicides R/S-metalaxyls (R/S-MTLs) and R/S-benalaxyls (R/S-BNLs) have different
biotoxicity. It is very important to unravel molecular recognition and enantiomeric separation …
biotoxicity. It is very important to unravel molecular recognition and enantiomeric separation …