Accueil > Productions scientifiques > Publications > 2013 > Equipe Modélisation et Dynamique Multiéchelles
Equipe Modélisation et Dynamique Multiéchelles
par - 5 mars 2013
Computation of pair distribution functions and three-dimensional densities with a reduced variance principle
D. Borgis, R. Assaraf, B. Rotenberg et R. Vuilleumier, Mol. Phys., 111, 3486 (2013).
Coarse graining the dynamics of nano-confined solutes : the case of ions in clays
A. Carof, V. Marry, M. Salanne, J.P. Hansen, P. Turq et B. Rotenberg, Mol. Simul., 40, 237 (2013).
Molecular Simulation of CO2- and CO3-Brine-Mineral Systems
L.H. Hamm, I.C. Bourg, A.F. Wallace et B. Rotenberg, Rev. Mineral. Geochem., 77, 189 (2013).
Highly confined ions store charge more efficiently in supercapacitors
C. Merlet, C. Péan, B. Rotenberg, P.A. Madden, B. Daffos, P.-L. Taberna, P. Simon et M. Salanne, Nature Comm., 4, 2701 (2013).
Computer simulations of ionic liquids at electrochemical interfaces
C. Merlet, B. Rotenberg, P.A. Madden et M. Salanne, Phys. Chem. Chem. Phys., 15, 15781 (2013).
Charge Fluctuations in Nanoscale Capacitors
D.T. Limmer, C. Merlet, M. Salanne, D. Chandler, P.A. Madden, R. van Roij et B. Rotenberg , Phys. Rev. Lett., 111, 106102 (2013).
Numerical homogenization of electrokinetic equations in porous media using lattice-Boltzmann simulations
A. Obliger, M. Duvail, M. Jardat, D. Coelho, S. Békri et B. Rotenberg, Phys. Rev. E, 88, 013019 (2013).
Accounting for adsorption and desorption in lattice Boltzmann simulations
M. Levesque, M. Duvail, I. Pagonabarraga, D. Frenkel et B. Rotenberg, Phys. Rev. E, 88, 013308 (2013).
Electrokinetics : insights from simulation on the microscopic scale (Topical Review)
B. Rotenberg et I. Pagonabarraga, Mol. Phys., 111, 827 (2013). Voir aussi l’éditorial.
Influence of solvation on the structural and capacitive properties of electrical double layer capacitors C. Merlet, M. Salanne, B. Rotenberg et P. Madden, Electrochimica Acta, 101, 262 (2013)
Molecular diffusion between walls with adsorption and desorption
M. Levesque, O. Benichou et B. Rotenberg, J. Chem. Phys., 138, 034107 (2013)
Simulating Supercapacitors : Can We Model Electrodes As Constant Charge Surfaces ?
C. Merlet, C. Péan, B. Rotenberg, P.A. Madden, P. Simon and M. Salanne, J. Phys. Chem. Lett., 4, 264 (2013)
How Electrostatics Influences Hydrodynamic Boundary Conditions : Poiseuille and Electro-osmostic Flows in Clay Nanopores.
A. Botan, V. Marry, B. Rotenberg, P. Turq, and B. Noetinger, J. Phys. Chem. C, 117, 978 (2013)
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