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Structural and Thermodynamics Studies on Polyaminophosphonate Ligands for Uranyl Decorporation

Inorganic chemistry, 2021-02, Vol.60 (4), p.2149-2159

2021

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Osteopontin: A Uranium Phosphorylated Binding-Site Characterization

Chemistry : a European journal, 2013-08, Vol.19 (34), p.11261-11269

2013

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Thermodynamic and Structural Investigation of Synthetic Actinide–Peptide Scaffolds

Inorganic chemistry, 2016-01, Vol.55 (2), p.877-886

2016

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Assignment of complex species by affinity capillary electrophoresis: The case of Th(IV)‐desferrioxamine B

Electrophoresis, 2020-11, Vol.41 (21-22), p.1870-1877

2020

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Neon diffusion in goethite, α-FeO(OH): a theoretical multi-scale study

Physics and chemistry of minerals, 2020-03, Vol.47 (3), Article 14

2020

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Revealing the radiation damage and Al-content impacts on He diffusion in goethite

Chemical geology, 2022-11, Vol.611, p.121118, Article 121118

2022

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Impact of apatite chemical composition on (U-Th)/He thermochronometry: An atomistic point of view

Geochimica et cosmochimica acta, 2015-10, Vol.167, p.162-176

2015

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Structural Environment and Stability of the Complexes Formed Between Calmodulin and Actinyl Ions

Inorganic chemistry, 2016-03, Vol.55 (6), p.2728-2736

2016

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Study of helium diffusion in yttria: A multiscale approach based on the density functional theory and kinetic Monte Carlo, with transmission electron microscopy and thermo-desorption spectroscopy

Journal of nuclear materials, 2024-08, Vol.597, p.155156, Article 155156

2024

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Understanding helium diffusion in iron: a multiscale modelling method based on the DFT and kinetic Monte Carlo, coupled to TEM and thermo-desorption spectroscopy experiments

Journal of nuclear materials, 2023-09, Vol.583, p.154511, Article 154511

2023

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Deactivation of lowest excited state of uranyl in the presence of acetate: A DFT exploration

Journal of photochemistry and photobiology. A, Chemistry., 2016-05, Vol.322-323, p.10-15

2016

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A multi-method, multi-scale theoretical study of He and Ne diffusion in zircon

Geochimica et cosmochimica acta, 2020-01, Vol.268, p.348-367

2020

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Influence of vacancy damage on He diffusion in apatite, investigated at atomic to mineralogical scales

Geochimica et cosmochimica acta, 2017-01, Vol.197, p.87-103

2017

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Actinide(IV) Deposits on Bone: Potential Role of the Osteopontin–Thorium Complex

Inorganic chemistry, 2016-01, Vol.55 (1), p.29-36

2016

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Is hydroxypyridonate 3,4,3-LI(1,2-HOPO) a good competitor of fetuin for uranyl metabolism?

Metallomics, 2019-02, Vol.11 (2), p.496-507

2019

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Cyclic Phosphopeptides to Rationalize the Role of Phosphoamino Acids in Uranyl Binding to Biological Targets

Chemistry : a European journal, 2017-04, Vol.23 (22), p.5281-5290

2017

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Helium diffusion in pure hematite (α-Fe2O3) for thermochronometric applications: A theoretical multi-scale study

Computational and theoretical chemistry, 2017-01, Vol.1099, p.21-28

2017

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Role of Defects and Radiation Damage on He Diffusion in Magnetite: Implication for (U-Th)/He Thermochronology

Minerals (Basel), 2022-05, Vol.12 (5), p.590

2022

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Periodic density functional theory investigation of the uranyl ion sorption on three mineral surfaces: a comparative study

International Journal of Molecular Sciences, 2009-06, Vol.10 (6), p.2633-2661

2009

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Computational investigation of interstitial neon diffusion in pure hematite

Computational materials science, 2017-02, Vol.128, p.67-74

2017

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Thermodynamic Study of the Complexation of Protactinium(V) with Diethylenetriaminepentaacetic Acid

Inorganic chemistry, 2013-07, Vol.52 (13), p.7497-7507

2013

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Ions in solutions: Determining their polarizabilities from first-principles

The Journal of chemical physics, 2011-01, Vol.134 (1), p.014511-014511-6

2011

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Theoretical Investigation of the Uranyl Ion Sorption on the Rutile TiO2(110) Face

Inorganic chemistry, 2008-12, Vol.47 (23), p.10991-10997

2008

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Towards the development of chitosan nanoparticles for plutonium pulmonary decorporation

Dalton transactions : an international journal of inorganic chemistry, 2018, Vol.47 (33), p.11605-11618

2018

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Car-Parrinello molecular dynamics study of the uranyl behaviour at the gibbsite/water interface

The Journal of chemical physics, 2012-10, Vol.137 (15), p.154705-154705

2012

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Structural and Thermodynamics Studies on Polyaminophosphonate Ligands for Uranyl Decorporation

Osteopontin: A Uranium Phosphorylated Binding-Site Characterization

Thermodynamic and Structural Investigation of Synthetic Actinide–Peptide Scaffolds

Assignment of complex species by affinity capillary electrophoresis: The case of Th(IV)‐desferrioxamine B

Neon diffusion in goethite, α-FeO(OH): a theoretical multi-scale study

Revealing the radiation damage and Al-content impacts on He diffusion in goethite

Impact of apatite chemical composition on (U-Th)/He thermochronometry: An atomistic point of view

Structural Environment and Stability of the Complexes Formed Between Calmodulin and Actinyl Ions

Study of helium diffusion in yttria: A multiscale approach based on the density functional theory and kinetic Monte Carlo, with transmission electron microscopy and thermo-desorption spectroscopy

Understanding helium diffusion in iron: a multiscale modelling method based on the DFT and kinetic Monte Carlo, coupled to TEM and thermo-desorption spectroscopy experiments

Deactivation of lowest excited state of uranyl in the presence of acetate: A DFT exploration

A multi-method, multi-scale theoretical study of He and Ne diffusion in zircon

Influence of vacancy damage on He diffusion in apatite, investigated at atomic to mineralogical scales

Actinide(IV) Deposits on Bone: Potential Role of the Osteopontin–Thorium Complex

Is hydroxypyridonate 3,4,3-LI(1,2-HOPO) a good competitor of fetuin for uranyl metabolism?

Cyclic Phosphopeptides to Rationalize the Role of Phosphoamino Acids in Uranyl Binding to Biological Targets

Helium diffusion in pure hematite (α-Fe2O3) for thermochronometric applications: A theoretical multi-scale study

Role of Defects and Radiation Damage on He Diffusion in Magnetite: Implication for (U-Th)/He Thermochronology

Periodic density functional theory investigation of the uranyl ion sorption on three mineral surfaces: a comparative study

Computational investigation of interstitial neon diffusion in pure hematite

Thermodynamic Study of the Complexation of Protactinium(V) with Diethylenetriaminepentaacetic Acid

Ions in solutions: Determining their polarizabilities from first-principles

Theoretical Investigation of the Uranyl Ion Sorption on the Rutile TiO2(110) Face

Towards the development of chitosan nanoparticles for plutonium pulmonary decorporation

Car-Parrinello molecular dynamics study of the uranyl behaviour at the gibbsite/water interface

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