Valérie Vallet

ORCID

Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 27

Top Venues

Inorganic chemistry

Physical chemistry chemical physics : PCCP

The Journal of chemical physics

Chemical science

CNRS Délégation Nord Pas de Calais

This page only lists publications with an associated author ORCID identifier.

Affiliation History

CNRS Délégation Nord Pas de Calais Oct 1o 2014

France

Director of research :: Laboratoire PhLAM

Publications

Marion Roy, Rahma Dahmani, Valérie Vallet, Michel Masella
Early Steps in the O 2 Scavenger Process in the Aqueous Phase: Hydrazine vs DEHA. The journal of physical chemistry. A (2023)
Hanna Oher, Jérémy Delafoulhouze, Eric Renault, Valérie Vallet, Rémi Maurice
Coordination and thermodynamic properties of aqueous protactinium(V) by first-principle calculations. Physical chemistry chemical physics : PCCP (2023)
Hanna Oher, André Severo Pereira Gomes, Richard E Wilson, David D Schnaars, Valérie Vallet
How Does Bending the Uranyl Unit Influence Its Spectroscopy and Luminescence? Inorganic chemistry (2023)
Jordan A Claus, Celina Bermúdez, Valérie Vallet, Laurent Margulès, Manuel Goubet
The hydration of an oxy-polycyclic aromatic compound: the case of naphthaldehyde. Physical chemistry chemical physics : PCCP (2023)
Luigi Genovese, William Dawson, Takahito Nakajima, Viviana Cristiglio, Valérie Vallet, Michel Masella
Protein-ligand interactions from a quantum fragmentation perspective: The case of the SARS-CoV-2 main protease interacting with α-ketoamide inhibitors. The Journal of chemical physics 158 (21) (2023)
Nadiya Zhutova, Florent Réal, Eric Renault, Valérie Vallet, Rémi Maurice
Excited states of polonium(IV): electron correlation and spin-orbit coupling in the Po 4+ free ion and in the bare and solvated [PoCl 5 ] - and [PoCl 6 ] 2- complexes. Physical chemistry chemical physics : PCCP (2023)
Nicholas R Andreychuk, Balamurugan Vidjayacoumar, Jeffrey S Price, Sophie Kervazo, Craig A Peeples, David J H Emslie, Valérie Vallet, André Severo Pereira Gomes, Florent Réal, Georg Schreckenbach, Paul W Ayers, Ignacio Vargas-Baca, Hilary A Jenkins, James F Britten
Uranium(iv) alkyl cations: synthesis, structures, comparison with thorium(iv) analogues, and the influence of arene-coordination on thermal stability and ethylene polymerization activity. Chemical science 13 (46) (2022)
Nadiya Zhutova, Florent Réal, Valérie Vallet, Rémi Maurice
Geometries, interaction energies and bonding in [Po(H 2 O) n ] 4+ and [PoCl n ] 4- n complexes. Physical chemistry chemical physics : PCCP 24 (42) (2022)
Matteo De Santis, Diego Sorbelli, Valérie Vallet, André Severo Pereira Gomes, Loriano Storchi, Leonardo Belpassi
Frozen-Density Embedding for Including Environmental Effects in the Dirac-Kohn-Sham Theory: An Implementation Based on Density Fitting and Prototyping Techniques. Journal of chemical theory and computation 18 (10) (2022)
Michael L Tarlton, Suntharalingam Skanthakumar, Valérie Vallet, Richard E Wilson
Hexanitrato complexes and hybrid double perovskites of Am 3+ and Cm 3 . Chemical communications (Cambridge, England) 58 (85) (2022)
Nicholas R Andreychuk, Balamurugan Vidjayacoumar, Jeffrey S Price, Sophie Kervazo, Craig A Peeples, David J H Emslie, Valérie Vallet, André Severo Pereira Gomes, Florent Réal, Georg Schreckenbach, Paul W Ayers, Ignacio Vargas-Baca, Hilary A Jenkins, James F Britten
Uranium(iv) alkyl cations: synthesis, structures, comparison with thorium(iv) analogues, and the influence of arene-coordination on thermal stability and ethylene polymerization activity. Chemical science 13 (46) (2022)
R Lee Ayscue, Valérie Vallet, Jeffery A Bertke, Florent Réal, Karah E Knope
Structure-Property Relationships in Photoluminescent Bismuth Halide Organic Hybrid Materials. Inorganic chemistry 60 (13) (2021)
Nina Huittinen, Isabelle Jessat, Florent Réal, Valérie Vallet, Sebastian Starke, Manuel Eibl, Norbert Jordan
Revisiting the Complexation of Cm(III) with Aqueous Phosphates: What Can We Learn from the Complex Structures Using Luminescence Spectroscopy and Ab Initio Simulations? Inorganic chemistry 60 (14) (2021)
Hanna Oher, Geoffroy Ferru, Laurent Couston, Laurence Berthon, Dominique Guillaumont, Florent Réal, Thomas Vercouter, Valérie Vallet
Influence of the First Coordination of Uranyl on Its Luminescence Properties: A Study of Uranyl Binitrate with N,N-Dialkyl Amide DEHiBA and Water. Inorganic chemistry (2021)
Hanna Oher, Thomas Vercouter, Florent Réal, Chengming Shang, Pascal E Reiller, Valérie Vallet
Influence of Alkaline Earth Metal Ions on Structures and Luminescent Properties of NamMnUO2(CO3)3(4-m-2n)- (M = Mg, Ca; m, n = 0-2): Time-Resolved Fluorescence Spectroscopy and Ab Initio Studies. Inorganic chemistry 59 (20) (2020)
Manuel Goubet, Marie-Aline Martin-Drumel, Florent Réal, Valérie Vallet, Olivier Pirali
Conformational Landscape of Oxygen-Containing Naphthalene Derivatives. The journal of physical chemistry. A 124 (22) (2020)
Hanna Oher, Florent Réal, Thomas Vercouter, Valérie Vallet
Investigation of the Luminescence of [UO2X4]2- (X = Cl, Br) Complexes in the Organic Phase Using Time-Resolved Laser-Induced Fluorescence Spectroscopy and Quantum Chemical Simulations. Inorganic chemistry 59 (9) (2020)
Céline Houriez, Florent Réal, Valérie Vallet, Michael Mautner, Michel Masella
Ion hydration free energies and water surface potential in water nano drops: The cluster pair approximation and the proton hydration Gibbs free energy in solution. The Journal of chemical physics 151 (17) (2019)
Florent Réal, Valérie Vallet, Michel Masella
Improving the description of solvent pairwise interactions using local solute/solvent three-body functions. The case of halides and carboxylates in aqueous environment. Journal of computational chemistry 40 (11) (2019)
Sophie Kervazo, Florent Réal, François Virot, André Severo Pereira Gomes, Valérie Vallet
Accurate Predictions of Volatile Plutonium Thermodynamic Properties. Inorganic chemistry 58 (21) (2019)
Patric Lindqvist-Reis, Florent Réal, Rafał Janicki, Valérie Vallet
Unraveling the Ground State and Excited State Structures and Dynamics of Hydrated Ce3+ Ions by Experiment and Theory. Inorganic chemistry 57 (16) (2018)
Richard E Wilson, Stephanie De Sio, Valérie Vallet
Protactinium and the intersection of actinide and transition metal chemistry. Nature communications 9 (1) (2018)
Mohamad Saab, Florent Réal, Martin Šulka, Laurent Cantrel, François Virot, Valérie Vallet
Facing the challenge of predicting the standard formation enthalpies of n-butyl-phosphate species with ab initio methods. The Journal of chemical physics 146 (24) (2018)
Katharina Boguslawski, Florent Réal, Paweł Tecmer, Corinne Duperrouzel, André Severo Pereira Gomes, Örs Legeza, Paul W Ayers, Valérie Vallet
On the multi-reference nature of plutonium oxides: PuO22+, PuO2, PuO3 and PuO2(OH)2. Physical chemistry chemical physics : PCCP 19 (6) (2018)
Céline Houriez, Valérie Vallet, Florent Réal, Michael Mautner, Michel Masella
Organic ion association in aqueous phase and ab initio-based force fields: The case of carboxylate/ammonium salts. The Journal of chemical physics 147 (16) (2018)
S Skanthakumar, Geng Bang Jin, Jian Lin, Valérie Vallet, L Soderholm
Linking Solution Structures and Energetics: Thorium Nitrate Complexes. The journal of physical chemistry. B 121 (36) (2017)
Valérie Vallet, Ingmar Grenthe
Structure and Bonding in Uranyl(VI) Peroxide and Crown Ether Complexes; Comparison of Quantum Chemical and Experimental Data. Inorganic chemistry 56 (24) (2017)

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Publication Activity (10 Years)

Top Topics

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Valérie Vallet