검색결과 : 11건
| No. | Article |
|---|---|
| 1 |
Investigation of the Structure of Concentrated NaOH Aqueous Solutions by Combining Molecular Dynamics and Wide-Angle X-ray Scattering Coste A, Poulesquen A, Diat O, Dufreche JF, Duvail M Journal of Physical Chemistry B, 123(24), 5121, 2019 |
| 2 |
Activity Coefficients of Aqueous Sodium, Calcium, and Europium Nitrate Solutions from Osmotic Equilibrium MD Simulations Bley M, Duvail M, Guilbaud P, Dufreche JF Journal of Physical Chemistry B, 122(31), 7726, 2018 |
| 3 |
A Combined Spectroscopic/Molecular Dynamic Study for Investigating a Methyl-Carboxylated PEI as a Potential Uranium Decorporation Agent Lahrouch F, Chamayou AC, Creff G, Duvail M, Hennig C, Rodriguez MJL, Den Auwer C, Di Giorgio C Inorganic Chemistry, 56(3), 1300, 2017 |
| 4 |
Simulating Osmotic Equilibria: A New Tool for Calculating Activity Coefficients in Concentrated Aqueous Salt Solutions Bley M, Duvail M, Guilbaud P, Dufreche JF Journal of Physical Chemistry B, 121(41), 9647, 2017 |
| 5 |
Revised Ionic Radii of Lanthanoid(III) Ions in Aqueous Solution D'Angelo P, Zitolo A, Migliorati V, Chillemi G, Duvail M, Vitorge P, Abadie S, Spezia R Inorganic Chemistry, 50(10), 4572, 2011 |
| 6 |
Complexation of Lanthanides(III), Americium(III), and Uranium(VI) with Bitopic N,O Ligands: an Experimental and Theoretical Study Marie C, Miguirditchian M, Guillaumont D, Tosseng A, Berthon C, Guilbaud P, Duvail M, Bisson J, Guillaneux D, Pipelier M, Dubreuil D Inorganic Chemistry, 50(14), 6557, 2011 |
| 7 |
Atomistic Description of Binary Lanthanoid Salt Solutions: A Coarse-Graining Approach Molina JJ, Duvail M, Dufreche JF, Guilbaud P Journal of Physical Chemistry B, 115(15), 4329, 2011 |
| 8 |
Temperature influence on lanthanoids (III) hydration from molecular dynamics simulations Duvail M, Vitorge P, Spezia R Chemical Physics Letters, 498(1-3), 90, 2010 |
| 9 |
Molecular Dynamics Studies of Concentrated Binary Aqueous Solutions of Lanthanide Salts: Structures and Exchange Dynamics Duvail M, Ruas A, Venault L, Moisy P, Guilbaud P Inorganic Chemistry, 49(2), 519, 2010 |
| 10 |
Temperature dependence of hydrated La3+ properties in liquid water, a molecular dynamics simulations study Duvail M, Spezia R, Cartailler T, Vitorge P Chemical Physics Letters, 448(1-3), 41, 2007 |