Valentina Migliorati | Ricerc@Sapienza

Pubblicazioni

Titolo	Pubblicato in	Anno
Simulations of γ-Valerolactone Solvents and Electrolytes for Lithium Batteries Using Polarizable Molecular Dynamics	MOLECULES	2025
Does Pb2+ form holodirected or hemidirected solvation geometries in water?	JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL	2024
Evolution of the La(III) ion coordination sphere in ethylammonium nitrate solution upon water addition	JOURNAL OF MOLECULAR LIQUIDS	2023
On the formation of inner-sphere solvation complexes in dilute acetonitrile solutions of the Hg(NO3)2 and Hg(TfO)2 salts: a Molecular Dynamics study	RESULTS IN CHEMISTRY	2023
Going beyond Radial Hydration Models: The Hidden Structures of Chloride and Iodide Aqua Ions Revealed by the Use of Lone Pairs	JOURNAL OF PHYSICAL CHEMISTRY. B, CONDENSED MATTER, MATERIALS, SURFACES, INTERFACES & BIOPHYSICAL	2023
Structural Study of a Eutectic Solvent Reveals Hydrophobic Segregation and Lack of Hydrogen Bonding between the Components	ACS SUSTAINABLE CHEMISTRY & ENGINEERING	2022
Crystalline structuring of confined ionic liquids at room temperature	JOURNAL OF PHYSICAL CHEMISTRY. C	2022
Response to Comment on "Structural Study of a Eutectic Solvent Reveals Hydrophobic Segregation and Lack of Hydrogen Bonding between the Components"	ACS SUSTAINABLE CHEMISTRY & ENGINEERING	2022
Solvation structure of the Hg(NO3)2 and Hg(TfO)2 salts in dilute aqueous and methanol solutions: An insight into the Hg2+ coordination chemistry	JOURNAL OF MOLECULAR LIQUIDS	2022
Direct Observation of Contact Ion-Pair Formation in La3+ Methanol Solution	INORGANIC CHEMISTRY	2022
Solubilization properties and structural characterization of dissociated HgO and HgCl2 in deep eutectic solvents	JOURNAL OF MOLECULAR LIQUIDS	2021
Transition from molecular- to nano-scale segregation in a deep eutectic solvent - water mixture	JOURNAL OF MOLECULAR LIQUIDS	2021
On the coordination chemistry of the lanthanum(III) nitrate salt in EAN/MeOH mixtures	INORGANIC CHEMISTRY	2021
Fate of a deep eutectic solvent upon cosolvent addition: choline chloride-sesamol 1:3 mixtures with methanol	ACS SUSTAINABLE CHEMISTRY & ENGINEERING	2021
Deep eutectic solvents: A structural point of view on the role of the anion	CHEMICAL PHYSICS LETTERS	2021
Anatomy of a deep eutectic solvent: structural properties of choline chloride : sesamol 1 : 3 compared to reline	PHYSICAL CHEMISTRY CHEMICAL PHYSICS	2021
Unraveling the solvation geometries of the lanthanum(III) bistriflimide salt in ionic liquid/acetonitrile mixtures	PHYSICAL CHEMISTRY CHEMICAL PHYSICS	2020
Elusive Coordination of the Ag+ Ion in Aqueous Solution: Evidence for a Linear Structure	INORGANIC CHEMISTRY	2020
Deep eutectic solvents: a structural point of view on the role of the cation	CHEMICAL PHYSICS LETTERS. X	2019
Response to "comment on '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'" [J. Chem. Phys. 150, 097101 (2019)]	THE JOURNAL OF CHEMICAL PHYSICS	2019