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Valérie Vallet

Showing results (31-40 of 85) with videos related to

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The Journal of Chemical Physics|September 9, 2004
Can density functional methods be used for open-shell actinide molecules? Comparison with multiconfigurational spin-orbit studiesCarine Clavaguéra-Sarrio, Valérie Vallet, Daniel Maynau, et al.
The Journal of Chemical Physics|November 10, 2019
Ion hydration free energies and water surface potential in water nano drops: The cluster pair approximation and the proton hydration Gibbs free energy in solutionCéline Houriez, Florent Réal, Valérie Vallet, et al.
Physical Chemistry Chemical Physics : PCCP|March 24, 2023
Coordination and thermodynamic properties of aqueous protactinium(V) by first-principle calculationsHanna Oher, Jérémy Delafoulhouze, Eric Renault, et al.
Journal of Computational Chemistry|December 13, 2012
Further insights in the ability of classical nonadditive potentials to model actinide ion-water interactionsFlorent Réal, Michael Trumm, Bernd Schimmelpfennig, et al.
The Journal of Physical Chemistry. A|April 24, 2015
Thermodynamic properties of gaseous ruthenium speciesFaoulat Miradji, Sidi Souvi, Laurent Cantrel, et al.
Chemical Communications (Cambridge, England)|October 11, 2022
Hexanitrato complexes and hybrid double perovskites of Am<sup>3+</sup> and Cm<sup>3</sup>Michael L Tarlton, Suntharalingam Skanthakumar, Valérie Vallet, et al.
Inorganic Chemistry|March 18, 2003
Structure and bonding in solution of dioxouranium(VI) oxalate complexes: isomers and intramolecular ligand exchangeValérie Vallet, Henry Moll, Ulf Wahlgren, et al.
Physical Chemistry Chemical Physics : PCCP|September 4, 2023
Excited states of polonium(IV): electron correlation and spin-orbit coupling in the Po<sup>4+</sup> free ion and in the bare and solvated [PoCl<sub>5</sub>]<sup>-</sup> and [PoCl<sub>6</sub>]<sup>2-</sup> complexesNadiya Zhutova, Florent Réal, Eric Renault, et al.
Physical Chemistry Chemical Physics : PCCP|January 13, 2021
Insights from quantum chemical calculations into inner and outer-sphere complexation of plutonium(IV) by monoamide and carbamide extractantsAbdelmounaim Failali, Eléonor Acher, Valérie Vallet, et al.
The Journal of Chemical Physics|October 22, 2005
Photochemistry of pyrrole: time-dependent quantum wave-packet description of the dynamics at the 1pi sigma*-S0 conical intersectionsValérie Vallet, Zhenggang Lan, Susanta Mahapatra, et al.
Pageof 9

Showing results (31-40 of 85) with videos related to

Sort By:
Pageof 9
The Journal of Chemical Physics|September 9, 2004
Can density functional methods be used for open-shell actinide molecules? Comparison with multiconfigurational spin-orbit studiesCarine Clavaguéra-Sarrio, Valérie Vallet, Daniel Maynau, et al.
The Journal of Chemical Physics|November 10, 2019
Ion hydration free energies and water surface potential in water nano drops: The cluster pair approximation and the proton hydration Gibbs free energy in solutionCéline Houriez, Florent Réal, Valérie Vallet, et al.
Physical Chemistry Chemical Physics : PCCP|March 24, 2023
Coordination and thermodynamic properties of aqueous protactinium(V) by first-principle calculationsHanna Oher, Jérémy Delafoulhouze, Eric Renault, et al.
Journal of Computational Chemistry|December 13, 2012
Further insights in the ability of classical nonadditive potentials to model actinide ion-water interactionsFlorent Réal, Michael Trumm, Bernd Schimmelpfennig, et al.
The Journal of Physical Chemistry. A|April 24, 2015
Thermodynamic properties of gaseous ruthenium speciesFaoulat Miradji, Sidi Souvi, Laurent Cantrel, et al.
Chemical Communications (Cambridge, England)|October 11, 2022
Hexanitrato complexes and hybrid double perovskites of Am<sup>3+</sup> and Cm<sup>3</sup>Michael L Tarlton, Suntharalingam Skanthakumar, Valérie Vallet, et al.
Inorganic Chemistry|March 18, 2003
Structure and bonding in solution of dioxouranium(VI) oxalate complexes: isomers and intramolecular ligand exchangeValérie Vallet, Henry Moll, Ulf Wahlgren, et al.
Physical Chemistry Chemical Physics : PCCP|September 4, 2023
Excited states of polonium(IV): electron correlation and spin-orbit coupling in the Po<sup>4+</sup> free ion and in the bare and solvated [PoCl<sub>5</sub>]<sup>-</sup> and [PoCl<sub>6</sub>]<sup>2-</sup> complexesNadiya Zhutova, Florent Réal, Eric Renault, et al.
Physical Chemistry Chemical Physics : PCCP|January 13, 2021
Insights from quantum chemical calculations into inner and outer-sphere complexation of plutonium(IV) by monoamide and carbamide extractantsAbdelmounaim Failali, Eléonor Acher, Valérie Vallet, et al.
The Journal of Chemical Physics|October 22, 2005
Photochemistry of pyrrole: time-dependent quantum wave-packet description of the dynamics at the 1pi sigma*-S0 conical intersectionsValérie Vallet, Zhenggang Lan, Susanta Mahapatra, et al.
Pageof 9