Theoretical Investigation of Actinide Ligation in Aqueous and Organic Phase for Nuclear Waste Treatment

Aqueous Speciation of Tetravalent Actinides in the Presence of Chloride and Nitrate Ligands

(2022) Rameswar Bhattacharjee et al.   INORGANIC CHEMISTRY

Theoretical Study of Effects of Solvents, Ligands, and Anions on Separation of Trivalent Lanthanides and Actinides

(2021) Ke Niu et al.   INORGANIC CHEMISTRY

Considering Density Functional Approaches for Actinide Species: The An66 Molecule Set

(2021) Lucas E. Aebersold et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Recovery of Oxidized Actinides, Np(VI), Pu(VI), and Am(VI), from Cocrystallized Uranyl Nitrate Hexahydrate: A Single Technology Approach to Used Nuclear Fuel Recycling

(2020) Jeffrey D. Einkauf et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Theoretical Insight into Coordination Chemistry of Am(VI) and Am(V) with Phenanthroline Ligand: Implications for High Oxidation State Based Minor Actinide Separation

(2020) Shu-Xian Hu et al.   INORGANIC CHEMISTRY

Selecting Quantum-Chemical Methods for Lanthanide-Containing Molecules: A Balance between Accuracy and Efficiency

(2020) Gavin A. McCarver et al.   INORGANIC CHEMISTRY

The ORCA quantum chemistry program package

(2020) Frank Neese et al.   JOURNAL OF CHEMICAL PHYSICS

Actinide Separation Inspired by Self-Assembled Metal–Polyphenolic Nanocages

(2020) Lei Mei et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Ultra-selective ligand-driven separation of strategic actinides

(2019) Gauthier J.-P. Deblonde et al.   Nature Communications

Closing the Nuclear Fuel Cycle with a Simplified Minor Actinide Lanthanide Separation Process (ALSEP) and Additive Manufacturing

(2019) Artem V. Gelis et al.   Scientific Reports

Bond Covalency and Oxidation State of Actinide Ions Complexed with Therapeutic Chelating Agent 3,4,3-LI(1,2-HOPO)

(2018) Morgan P. Kelley et al.   INORGANIC CHEMISTRY

Chelation and stabilization of berkelium in oxidation state +IV

(2017) Gauthier J.-P. Deblonde et al.   Nature Chemistry

Intramolecular sensitization of americium luminescence in solution: shining light on short-lived forbidden 5f transitions

(2016) M. Sturzbecher-Hoehne et al.   DALTON TRANSACTIONS

Group Hexavalent Actinide Separations: A New Approach to Used Nuclear Fuel Recycling

(2016) Jonathan D. Burns et al.   INORGANIC CHEMISTRY

Synthesis and Screening of Modified 6,6′-Bis(5,5,8,8-tetramethyl-5,6,7,8-tetrahydrobenzo[e][1,2,4]triazin-3-yl)-2,2′-bipyridine Ligands for Actinide and Lanthanide Separation in Nuclear Waste Treatment

(2016) Ashfaq Afsar et al.   JOURNAL OF ORGANIC CHEMISTRY

Hydrophilic Clicked 2,6-Bis-triazolyl-pyridines Endowed with High Actinide Selectivity and Radiochemical Stability: Toward a Closed Nuclear Fuel Cycle

(2016) Elena Macerata et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Extraction of Lanthanide and Actinide Ions from Aqueous Mixtures Using a Carboxylic Acid-Functionalized Porous Aromatic Framework

(2016) Selvan Demir et al.   ACS Central Science

Quantum Chemical Calculations and Experimental Investigations of Molecular Actinide Oxides

(2015) Attila Kovács et al.   CHEMICAL REVIEWS

Probing the difference in covalence by enthalpy measurements: a new heterocyclic N-donor ligand for actinide/lanthanide separation

(2015) Yanqiu Yang et al.   DALTON TRANSACTIONS

Theoretical prediction of Am(iii)/Eu(iii) selectivity to aid the design of actinide-lanthanide separation agents

(2015) Vyacheslav S. Bryantsev et al.   DALTON TRANSACTIONS

The selectivity of diglycolamide (TODGA) and bis-triazine-bipyridine (BTBP) ligands in actinide/lanthanide complexation and solvent extraction separation – a theoretical approach

(2015) Jerzy Narbutt et al.   DALTON TRANSACTIONS

Hydroxypyridinonate Complex Stability of Group (IV) Metals and Tetravalent f-Block Elements: The Key to the Next Generation of Chelating Agents for Radiopharmaceuticals

(2015) Manuel Sturzbecher-Hoehne et al.   INORGANIC CHEMISTRY

Highly Luminescent and Stable Hydroxypyridinonate Complexes: A Step Towards New Curium Decontamination Strategies

(2014) Manuel Sturzbecher-Hoehne et al.   CHEMISTRY-A EUROPEAN JOURNAL

Excellent Selectivity for Actinides with a Tetradentate 2,9-Diamide-1,10-Phenanthroline Ligand in Highly Acidic Solution: A Hard–Soft Donor Combined Strategy

(2014) Cheng-Liang Xiao et al.   INORGANIC CHEMISTRY

Complexation and Extraction of Trivalent Actinides and Lanthanides by Triazinylpyridine N-Donor Ligands

(2013) Petra J. Panak et al.   CHEMICAL REVIEWS

Complexation of Cm(iii) and Eu(iii) with CyMe4-BTPhen and CyMe4-BTBP studied by time resolved laser fluorescence spectroscopy

(2013) Antje Bremer et al.   DALTON TRANSACTIONS

Solution Thermodynamic Stability of Complexes Formed with the Octadentate Hydroxypyridinonate Ligand 3,4,3-LI(1,2-HOPO): A Critical Feature for Efficient Chelation of Lanthanide(IV) and Actinide(IV) Ions

(2013) Gauthier J-P. Deblonde et al.   INORGANIC CHEMISTRY

Use of Soft Heterocyclic N-Donor Ligands To Separate Actinides and Lanthanides

(2012) Michael J. Hudson et al.   INORGANIC CHEMISTRY

2,6-Bis(5-(2,2-dimethylpropyl)-1H-pyrazol-3-yl)pyridine as a Ligand for Efficient Actinide(III)/Lanthanide(III) Separation

(2012) Antje Bremer et al.   INORGANIC CHEMISTRY

Trivalent Actinide and Lanthanide Separations by Tetradentate Nitrogen Ligands: A Quantum Chemistry Study

(2011) Jian-Hui Lan et al.   INORGANIC CHEMISTRY

All-Electron Scalar Relativistic Basis Sets for the Actinides

(2011) Dimitrios A. Pantazis et al.   Journal of Chemical Theory and Computation

Systematic optimization of long-range corrected hybrid density functionals

(2008) Jeng-Da Chai et al.   JOURNAL OF CHEMICAL PHYSICS

All-Electron Scalar Relativistic Basis Sets for Third-Row Transition Metal Atoms

(2008) Dimitrios A. Pantazis et al.   Journal of Chemical Theory and Computation