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Solvation of fluoro and mixed fluoro/chloro complexes of EuIII in the [BMI][PF6] room temperature ionic liquid. A theoretical study
Solvation of Uranyl(II) and Europium(III) Cations and Their Chloro Complexes in a Room-Temperature Ionic Liquid. A Theoretical Study of the Effect of Solvent “Humidity”
Solvation of Uranyl(II), Europium(III) and Europium(II) Cations in“Basic” Room-Temperature Ionic Liquids: A Theoretical Study
Macrotricyclic quaternary tetraammonium receptors: Halide anion recognition and interfacial activity at an aqueous interface. A molecular dynamics investigation
Solvation of M 3+ lanthanide cations in room-temperature ionic liquids. A molecular dynamics investigation
M 3+ Lanthanide Chloride Complexes in “Neutral” Room Temperature Ionic Liquids:  A Theoretical Study
Bromide Complexation by the Eu III Lanthanide Cation in Dry and Humid Ionic Liquids: A Molecular Dynamics PMF Study
Interactions between Keggin Anions in Water: The Higher Their Charge, the Higher Their Condensation? A Simulation Study
Cation extraction by 18-crown-6 to a room-temperature ionic liquid: The effect of solvent humidity investigated by molecular dynamics simulations
Interfacial Activity of the Diprotonated 222 Cryptand at the Water/"Oil" Interface Revealed by Molecular Dynamics Simulations
Unraveling the Role of Water in the Stereoselective Step of Aqueous Proline-Catalyzed Aldol Reactions
Accumulation of host-guest ion complexes with different counterions at the water-supercritical CO2 interface: a molecular dynamics study
Uranyl and Strontium Salt Solvation in Room-Temperature Ionic Liquids. A Molecular Dynamics Investigation
Halide Anion Capture and Recognition by a Tetrahedral Tetraammonium Receptor in Water: A Molecular Dynamics Investigation
Ab Initio Molecular Dynamics of Liquid 1,3-Dimethylimidazolium Chloride
Formation of Long, Multicenter π-[TCNE] 2 2− Dimers in Solution: Solvation and Stability Assessed through Molecular Dynamics Simulations
Distributed Polarizability Models for Imidazolium-Based Ionic Liquids
Speciation of La(III) Chloride Complexes in Water and Acetonitrile: A Density Functional Study
Is Charge Scaling Really Mandatory when Developing Fixed-Charge Atomistic Force Fields for Deep Eutectic Solvents?
Aqueous interfaces with hydrophobic room-temperature ionic liquids: A molecular dynamics study

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