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Maison de la Simulation - DRF

Présentation du laboratoire

La Maison de la Simulation est un laboratoire regroupant cinq partenaires académiques (CEA, CNRS, INRIA, Université d'Orsay et Université de Versailles-Saint-Quentin) qui a pour objectif d'accompagner, de soutenir et de stimuler les communautés scientifiques afin de tirer le meilleur parti des supercalculateurs. De tels supercalculateurs rendent possible des avancées dans les différents domaines scientifiques mais aussi contribuer à des avancées conséquentes en terme de compétitivité industrielle.

Les 20 dernières publications

Titre Auteurs Date de publication Source
Electronic structure and optical properties of quantum crystals from first principles calculations in the Born-Oppenheimer approximation Carlo Pierleoni, Vitaly Gorelov 21/12/2020 The Journal of chemical physics
Electronic energy gap closure and metal-insulator transition in dense liquid hydrogen Carlo Pierleoni, Vitaly Gorelov 19/11/2020 Physical Review B
Tackling Solvent Effects by Coupling Electronic and Molecular Density Functional Theory Daniel Borgis 10/11/2020 Journal of chemical theory and computation
Rotational spectral modulation of cloudless atmospheres for L/T brown dwarfs and extrasolar giant planets Pascal Tremblin, A. Emery 01/11/2020 Astronomy and Astrophysics
A library of self-consistent simulated exoplanet atmospheres Pascal Tremblin 01/11/2020 Monthly Notices of the Royal Astronomical Society
Quantum Monte Carlo determination of the principal Hugoniot of deuterium Carlo Pierleoni, Michele Ruggeri 22/10/2020 Physical Review B
Performance portability of lattice Boltzmann methods for two-phase flows with phase change Alain Cartalade, Werner Verdier 01/10/2020 Computer Methods in Applied Mechanics and Engineering
Efficient cylindrical envelope modeling for laser wakefield acceleration J. Derouillat 18/09/2020 Journal of Physics: Conference Series
Single Domain Multiple Decompositions for Particle-in-Cell simulations J. Derouillat 18/09/2020 Journal of Physics: Conference Series
Numerical modeling of laser tunneling ionization in particle-in-cell codes with a laser envelope model J. Derouillat 14/09/2020 Physical Review E
Competitive Salt Precipitation/Dissolution During Free-Water Reduction in Water-in-Salt Electrolyte Mathieu Salanne, Benjamin Rotenberg, Zhujie Li 07/09/2020 Angewandte Chemie
ARES. II. Characterizing the Hot Jupiters WASP-127 b, WASP-79 b, and WASP-62b with the Hubble Space Telescope Mathilde Poveda 01/09/2020 Astronomical Journal
ARES. III. Unveiling the Two Faces of KELT-7 b with HST WFC3 Mathilde Poveda 01/09/2020 Astronomical Journal
Characterization of molecular-atomic transformation in fluid hydrogen under pressure via long-wavelength asymptote of charge density fluctuations Carlo Pierleoni 15/08/2020 Journal of Molecular Liquids
Simple Parameter-Free Bridge Functionals for Molecular Density Functional Theory. Application to Hydrophobic Solvation Daniel Borgis, Sohvi Luukkonen 06/08/2020 The journal of physical chemistry. B
Predicting Hydration Free Energies of the FreeSolv Database of Drug-like Molecules with Molecular Density Functional Theory Daniel Borgis, Sohvi Luukkonen 27/07/2020 Journal of Chemical Information and Modeling
Ares i: Wasp-76 b, a tale of two hst spectra Mathilde Poveda 01/07/2020 Astronomical Journal
A first-principles investigation of the structural and electrochemical properties of biredox ionic species in acetonitrile Mathieu Salanne, Kyle G. Reeves 21/05/2020 Physical Chemistry Chemical Physics
Automatic labeling of cortical sulci using patch- or CNN-based segmentation techniques combined with bottom-up geometric constraints Martial Mancip 01/05/2020 Medical Image Analysis
A new set of atmosphere and evolution models for cool T-Y brown dwarfs and giant exoplanets Pascal Tremblin 01/05/2020 Astronomy and Astrophysics

Nombre de publications du laboratoire par domaine scientifique

Chaque publication du laboratoire peut être rangée dans une ou plusieurs disciplines scientifiques : la figure ci-dessus présente le nombre de publications du laboratoire pour chaque discipline de la classification ASJC (Elsevier)