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List of works by Philippe Guilbaud

Actinide speciation in relation to biological processes

scientific article published on 26 July 2006

Activity Coefficients of Aqueous Sodium, Calcium, and Europium Nitrate Solutions from Osmotic Equilibrium MD Simulations

scientific article published on 26 July 2018

Atomistic description of binary lanthanoid salt solutions: a coarse-graining approach.

scientific article published on 28 March 2011

Complexation of Actinide(III) and Lanthanide(III) with H4TPAEN for a Separation of Americium from Curium and Lanthanides.

scientific article

Complexation of Lanthanides(III), Americium(III), and Uranium(VI) with Bitopic N,O Ligands: an Experimental and Theoretical Study ⬇️

scientific article published on June 10, 2011

Complexation-induced supramolecular assembly drives metal-ion extraction

scientific article

Coordination of Tetravalent Actinides (An=ThIV , UIV , NpIV , PuIV ) with DOTA: From Dimers to Hexamers.

scientific article published on 10 March 2017

Determination of the Structures of Uranyl-Tri-n-butyl-Phosphate Aggregates by Coupling Experimental Results with Molecular Dynamic Simulations.

scientific article published on 3 October 2017

Effect of chemical environment on the radiation chemistry of N,N-di-(2-ethylhexyl)butyramide (DEHBA) and plutonium retention

scientific article published on 16 September 2019

Elucidation of the structure of organic solutions in solvent extraction by combining molecular dynamics and X-ray scattering

scientific article published on 11 April 2014

Experimental and molecular dynamics studies of dysprosium(III) salt solutions for a better representation of the microscopic features used within the binding mean spherical approximation theory

scientific article published in October 2006

High-throughput computational screening of nanoporous materials in targeted applications

scientific article published in 2022

Insight of the Metal-Ligand Interaction in f-Element Complexes by Paramagnetic NMR Spectroscopy

scientific article published on 28 February 2019

Liquid/liquid interface in periodic boundary condition

scientific article published on 23 December 2020

Molecular dynamics studies of concentrated binary aqueous solutions of lanthanide salts: structures and exchange dynamics

scientific article published on 01 January 2010

Multi-scale modelling of uranyl chloride solutions.

scientific article published on January 2015

Perrhenate and pertechnetate complexation by an azacryptand in nitric acid medium

scientific article published on 01 February 2020

Probing the existence of uranyl trisulfate structures in the AMEX solvent extraction process

scientific article published on 12 June 2019

Radiolytic stability of N,N-dialkyl amide: effect on Pu(iv) complexes in solution.

scientific article published on 7 December 2017

Simulating Osmotic Equilibria: A New Tool for Calculating Activity Coefficients in Concentrated Aqueous Salt Solutions

scientific article

Solute-induced microstructural transition from weak aggregates towards a curved film of surface-active extractants

scientific article published on 17 January 2012

Specific interaction between uranium anionic complexes and the cations of bis(trifluoromethylsulfonyl)imide based ionic liquids

scientific article published on 10 September 2013

Stability of reverse micelles in rare-earth separation: a chemical model based on a molecular approach.

scientific article published on 22 February 2017

Structural Analysis of Uranyl Complexation by the EF-Hand Motif of Calmodulin: Effect of Phosphorylation.

scientific article published on 4 September 2017

Synergism in a HDEHP/TOPO Liquid-Liquid Extraction System: An Intrinsic Ligands Property?

scientific article published on 08 March 2016

The role of curvature effects in liquid-liquid extraction: assessing organic phase mesoscopic properties from MD simulations.

scientific article published on 31 July 2017

Thermodynamics of Calcium binding to the Calmodulin N-terminal domain to evaluate site-specific affinity constants and cooperativity.

scientific article

Understanding the nitrate coordination to Eu3+ ions in solution by potential of mean force calculations ⬇️

scientific article published on February 15, 2011

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