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Articles: 1'968'170
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03 July 2020
 
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Results 1 to 12 of 12 for query "Rodolphe Vuilleumier". (0.01 sec.)


1.
On the mass of atoms in molecules: Beyond the Born-Oppenheimer approximation
Arne Scherrer; Federica Agostini; Daniel Sebastiani; E. K. U. Gross; Rodolphe Vuilleumier;
13 May 2016
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2.
Molecular hydrodynamics from memory kernels
Dominika Lesnicki; Rodolphe Vuilleumier; Antoine Carof; Benjamin Rotenberg;
10 May 2016
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3.
Nuclear velocity perturbation theory for vibrational circular dichroism: An approach based on the exact factorization of the electron-nuclear wave function
Arne Scherrer; Federica Agostini; Daniel Sebastiani; E. K. U. Gross; Rodolphe Vuilleumier;
16 May 2015
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4.
Challenges in first-principles NPT molecular dynamics of soft porous crystals: A case study on MIL-53(Ga)
Volker Haigis; Yacine Belkhodja; François-Xavier Coudert; Rodolphe Vuilleumier; Anne Boutin;
16 Sep 2014
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5.
Maximum probability domains for the analysis of the microscopic structure of liquids
Federica Agostini; Giovanni Ciccotti; Andreas Savin; Rodolphe Vuilleumier;
7 Sep 2014
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6.
Molecular Density Functional Theory of Water
Guillaume Jeanmairet; Maximilien Levesque; Rodolphe Vuilleumier; Daniel Borgis;
12 Feb 2013
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7.
Solvation of complex surfaces via molecular density functional theory
Maximilien Levesque; Virginie Marry; Benjamin Rotenberg; Guillaume Jeanmairet; Rodolphe Vuilleumier; Daniel Borgis;
20 Nov 2012
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8.
A transferable ab-initio based force field for aqueous ions
Sami Tazi; John J. Molina; Benjamin Rotenberg; Pierre Turq; Rodolphe Vuilleumier; Mathieu Salanne;
10 Apr 2012
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9.
Including many-body effects in models for ionic liquids
Mathieu Salanne; Benjamin Rotenberg; Sandro Jahn; Rodolphe Vuilleumier; Christian Simon; Paul A. Madden;
6 Apr 2012
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10.
Ab initio molecular dynamics for molecules with variable numbers of electrons
Ivano Tavernelli; Rodolphe Vuilleumier; Michiel Sprik;
27 May 2002   /  Phys Rev Lett, 88 (21), 213002
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11.
Molecular dynamics simulations of a silver atom in water: evidence for a dipolar excitonic state
Riccardo Spezia; CÚdric Nicolas; Anne Boutin; Rodolphe Vuilleumier;
14 Nov 2003   /  Phys Rev Lett, 91 (20), 208304
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12.
Visualizing chemical reactions in solution by picosecond x-ray diffraction
Anton Plech; Michael Wulff; Savo Bratos; Fabien Mirloup; Rodolphe Vuilleumier; Friedrich Schotte; Philip A Anfinrud;
26 Mar 2004   /  Phys Rev Lett, 92 (12), 125505
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