New bis(triazinyl) pyridines for selective extraction of americium(iii)
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January 2006 |
Constant pressure molecular dynamics for molecular systems
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December 1983 |
Recent advances in metal extraction improvement: Mixture systems consisting of ionic liquid and molecular extractant
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February 2019 |
Diglycolamide-Based Solvent Systems in Room Temperature Ionic Liquids for Actinide Ion Extraction: A Review
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June 2015 |
A molecular dynamics method for simulations in the canonical ensemble
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June 1984 |
Development and Testing of the OPLS All-Atom Force Field on Conformational Energetics and Properties of Organic Liquids
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January 1996 |
Highly Efficient Separation of Actinides from Lanthanides by a Phenanthroline-Derived Bis-triazine Ligand
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August 2011 |
GROMACS: A message-passing parallel molecular dynamics implementation
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September 1995 |
Actinide selectivity of 1,10-phenanthroline-2,9-dicarboxamide and its derivatives: a theoretical prediction followed by experimental validation
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January 2015 |
Structure and Conformational Response of Pure and Lithium-Doped Ionic Liquids to Pressure Alterations from Molecular Dynamics Simulations
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March 2020 |
Particle mesh Ewald: An N ⋅log( N ) method for Ewald sums in large systems
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June 1993 |
Actinide Partitioning—A Review
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May 2001 |
Selective Extraction of Minor Actinides from Acidic Media Using Symmetric and Asymmetric Dithiophosphinic Acids
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July 2010 |
Task-specific ionic liquids for the extraction of metal ions from aqueous solutions
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January 2001 |
THE weighted histogram analysis method for free-energy calculations on biomolecules. I. The method
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October 1992 |
Interaction of 6,6′′-bis(5,5,8,8-tetramethyl-5,6,7,8-tetrahydro-1,2,4-benzotriazin-3-yl)-2,2′:6′,2′′-terpyridine (CyMe4-BTTP) with some trivalent ions such as lanthanide(iii) ions and americium(iii)
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January 2010 |
GROMACS: Fast, flexible, and free
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January 2005 |
2,9-Dicarbonyl-1,10-phenanthroline derivatives with an unprecedented Am(iii)/Eu(iii) selectivity under highly acidic conditions
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January 2013 |
Use of dicyanamide ionic liquids for extraction of metal ions
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January 2016 |
GROMACS 3.0: a package for molecular simulation and trajectory analysis
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August 2001 |
Hydrophilic Sulfonated 2,9-Diamide-1,10-phenanthroline Endowed with a Highly Effective Ligand for Separation of Americium(III) from Europium(III): Extraction, Spectroscopy, and Density Functional Theory Calculations
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December 2020 |
Fast selective homogeneous extraction of UO22+ with carboxyl-functionalised task-specific ionic liquids
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March 2017 |
Polymorphic transitions in single crystals: A new molecular dynamics method
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December 1981 |
Controlling the Intermediate Structure of an Ionic Liquid for f-Block Element Separations
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April 2017 |
Complexation behavior of trivalent actinides and lanthanides with 1,10-phenanthroline-2,9-dicarboxylic acid based ligands: insight from density functional theory
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January 2012 |
Density of 1-Butyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)amide and 1-Hexyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)amide over an Extended Pressure Range up to 250 MPa
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April 2015 |
Selective separation of americium from europium using 2,9-bis(triazine)-1,10-phenanthrolines in ionic liquids: a new twist on an old story
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January 2017 |
A highly efficient solvent system containing TODGA in room temperature ionic liquids for actinide extraction
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August 2012 |
GROMACS: High performance molecular simulations through multi-level parallelism from laptops to supercomputers
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September 2015 |
Task-Specific Ionic Liquids Incorporating Novel Cations for the Coordination and Extraction of Hg 2+ and Cd 2+ : Synthesis, Characterization, and Extraction Studies
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June 2002 |
Molecular dynamics simulation of the room-temperature ionic liquid 1-butyl-3-methylimidazolium tetrafluoroborate
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December 2007 |
Machine learning for interatomic potential models
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February 2020 |
Development of an All-Atom Force Field for Heterocycles. Properties of Liquid Pyrrole, Furan, Diazoles, and Oxazoles
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October 1998 |
Excellent Selectivity for Actinides with a Tetradentate 2,9-Diamide-1,10-Phenanthroline Ligand in Highly Acidic Solution: A Hard–Soft Donor Combined Strategy
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January 2014 |
On the development of polarizable and Lennard-Jones force fields to study hydration structure and dynamics of actinide(III) ions based on effective ionic radii
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October 2017 |
A Second Generation Force Field for the Simulation of Proteins, Nucleic Acids, and Organic Molecules
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May 1995 |
The structures of CyMe 4 -BTBP complexes of americium( iii ) and europium( iii ) in solvents used in solvent extraction, explaining their separation properties
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January 2015 |
Selective Extraction of Americium(III) over Europium(III) Ions with Pyridylpyrazole Ligands: Structure–Property Relationships
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January 2017 |
Molecular Dynamics Simulations of Ionic Liquids and Electrolytes Using Polarizable Force Fields
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May 2019 |
Selective separation of trivalent f-ions using 1,10-phenanthroline-2,9-dicarboxamide ligands in ionic liquids
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January 2016 |
6,6′-bis-(5,6-diethyl-[1,2,4]triazin-3-yl)-2,2′-bipyridyl the first example of a new class of quadridentate heterocyclic extraction reagents for the separation of americium(III) and europium(III)
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March 2005 |
Characterization of Biaryl Torsional Energetics and its Treatment in OPLS All-Atom Force Fields
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April 2013 |
Molecular Force Field for Ionic Liquids Composed of Triflate or Bistriflylimide Anions
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October 2004 |
Development of an all-atom force field for heterocycles. Properties of liquid pyridine and diazenes
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February 1998 |