
2021
Generalized Langevin Equations in classical and quantum simulations
ISCD – Sorbonne Université – 4 Place Jussieu, Paris – 4-6 Octobre 2021
(iscd.sorbonne-universite.fr/events)
S. Bonella (EPF-Lausanne)
C. Hartmann (BTU Cottbus-Senftenberg)
S. Huppert (Sorbonne Université)
F. Pietrucci (Sorbonne Université)
- Proposition + Programme
- Compte-rendu
2019
Multi-Scale modelling of biological processes?
Paris – 20 et 21 mars 2019
Sterpone Fabio (LBT/IBPC, France), Derreumaux Philippe (Univ. Paris Diderot, France), Melchionna Simone (Univ. La Sapienza, Rome, Italy)
- Proposition
- Programme
- Compte-rendu
2018
Coarse-graining with Machine Learning in molecular dynamics
Chilly-Mazarin – 4 au 6 décembre 2019
Paraskevi Gkeka (Sanofi Chilly-Mazarin, France), Tony Lelièvre (Ecole des Ponts and INRIA Paris, France), Pierre Monmarché (Sorbonne Université, France), Gabriel Stoltz (Ecole des Ponts and INRIA Paris, France)
- Proposition
- Programme
- Compte-rendu
Is a project for the history of Molecular Simulation timely? How to do it?
Paris – 30 mai-1er juin 2018
Gianni Battimelli (Univ. Rome), Giovanni Ciccotti (Univ. Rome), Jean-Pierre Hansen (Univ. Cambridge), Rodolphe Vuilleumier (ENS Paris)
This meeting is a joint action supported by the CECAM-Moser, Paris; the SCM-Berlin node and the DFG Collaborative Research Center « Scaling Cascades in Complex Systems”; and the CECAM headquarters in Lausanne
- Proposition
- Programme
- Abstracts
- Compte-rendu
Simulations (and theory) in Physical chemistRy : an international Kermesse in Paris
Paris – 28 et 29 mai 2018
Rodolphe Vuilleumier (ENS Paris), Marie-Pierre Gaigeot (Univ. Evry),Marialore Sulpizi (Univ. of Mainz)
- Proposition
- Programme
- Compte-rendu
Numerical appoaches for ultrafast electron-nuclear dynamics
Paris – 24-26 janvier 2018
Aurélien de la Lande (Univ. Paris-Sud), Phuong Mai Dinh (Univ. Toulouse), Eve Ranvier (Univ. Paris-Sud), Valérie Véniard (Ecole Polytechnique)
- Proposition
- Programme
- Compte-rendu
2017
Quantum Crystallography : Current Developments and Future Perspectives
Nancy – 19-20 juin 2017
Alessandro GENONI (Univ. Lorraine), Simon GRABOWSKY (Univ. of Bremen, Germany)
Practical problems with dynamical nuclear quantum effects through semi-classical methods
Paris – 26-28 juin 2017
Fabio FINOCCHI (Univ. Pierre et Marie Curie), Philippe DEPONDT (Univ. Pierre et Marie Curie)
Modelling bio-molecular interactions : A multi-scale approach joining theory and experiment
Université Paris-Est Marne-la-Vallé – 18-19 mai 2017
Halima Mouhib (Université Paris-Est Marne-La-Vallée), Eric Ruelland (iEEs Université Paris-Est Créteil), Wolfgang Stahl (Aachen University)
2016
Méthodes avancées en dynamique moléculaire
IDRIS, Orsay- 10 mars 2016
Daniel BORGIS (CECAM-MOSER), Sara BONELLA (CECAM-LAUSANNE)
Algorithms and codes for the simulation of explicit electrodes
Paris, 20-21 juillet 2016
Mathieu SALANNE (UPMC), Benjamin ROTENBERG (UPMC),
Collaborative development of a modern program based on Maximum Probability Domains search
Paris, 4 rencontres en 2016
Benoît BRAÏDA (UPMC), Pascal FREY (UPMC), Patrick BULTINCK (Univ. Gand), Angel Martin ENDAS (Univ. de Oviedo)
2015
Development of the maximum probability domains
Paris – Printemps 2015
Benoît BAÏDA (Univ. Pierre et Marie Curie), Pascal FREY (Univ. Pierre et Marie Curie)
- Proposition
- Programme
- Compte-rendu
2014
Dislocation Dynamics Simulations : trends and challenges
Maison de la Simulation – 10-12 décembre 2014
L. Dupuy (CEA, Saclay), O. Coulaud (Grenoble), M. Fivel (Bordeaux), M. Blétry (Thiais)
Correlation Meeting
Ecole Polytechnique – 8-9 December 2014
F. Sottile (LSI, Ecole Polytechnique, Palaiseau), P. Romaniello (LPT, Université de Toulouse)
Développement de codes de chimie théorique dans un environnement HPC
Paris – Automne 2014
Maximilien LEVESQUE (ENS) , Bernard LEVY (Univ. Paris Sud), Philippe PIQUEMAL (Univ. Pierre et Marie Curie)
- Proposition
- Programme
- Compte-rendu
Excited states from small molecules to more complex systems
Université Paris-Est Marne-la-Vallé – April 2014
Isabelle Navizet (Univ. Paris-Est Marne-la-Vallée), Nicolas Ferré (Univ. Aix-Marseille), Valérie Brenner (CEA)
Simulation of systems under thermodynamic gradients
UPMC Paris -24-25 March 2014
Benjamin Rotenberg (UPMC), Emmanuel Trizac (Univ. Paris Sud), Ignacio Pagonabarraga (Univ. barcelona)
Pseudopotentials and PAW atomic data: beyond a « back art » ?
Paris – 28-29 January 2014
François Jollet (CEA/DAM/DIF) , Gian-Marco Rignanese (Univ. Louvain-La-Neuve), Jens Jorgen Mortensen (Danmarks Tekniske Univ.)
- Proposition
- Programme
- Compte-rendu
2013
Journée française de visualisation scientifique VISU 2013
IBPC Paris, octobre 2013
Marc Baaden (CNRS), Michaël Aupetit (CEA)
Modeling Oxide/Water Interface and Reactivity
Paris, Septembre 2013
Dominique Costa (ENSCP), Marie-Pierre Gaigeot (Université d’Evry)
Modelling ionic liquids at electrochemical interfaces
UPMC Paris 5-6 september
Mathieu Salanne ( UPMC); Benjamin Rotenberg (UPMC), Patrice Simon (Univ. Paul Sabatier)
Topological approaches to intermolecular interactions
UPMC Paris, June 2013
Julia Contreras-Garcia (UPMC), Jean-Philip Piquemal (UPMC), Robin Chaudret (IFP), Erin Johnson (UC, Merced)
Experimental and theoretical charaterization fo macromolecular assemblies at low resolution
IBPC Paris, 8-9 april 2013
Chantal Prévost (IBPC), Tâp Ha-Duong (UPSud), Mounir Tarek (Univ. Lorraine)
Moving heterogeneities and elastodynamic wave propagation : simulation and detection
Institut Henri Poincaré – 28 May 2013
Yves-Patrick Pellegrini (CEA/DAM/DIF)
Physical and biological nanofluidics
Institut Henri Poincaré – 23-24 May 2013
Lois Auvray (Univ. Paris Diderot), Fabien Montel (Univ. Paris Diderot), Jérôme Mathé (UEVE)
Maison de la Simulation, march 2013
Véronique Thomas-Vaslin (UPMC), Abi-Haidar Alaa (UPMC)
Multi-scale modelling: applications to physicochemical processes
IHP Paris, 11-15 february
Pierre Turq (UPMC), Jean-François Dufrêche (ICSM/Marcoule)
Université Paris Diderot – 9-11 January 2013
François Graner (Univ. Paris Diderot) , Simon Cox (Aberystwith Univ.)
2012
Ecole Polytechnique – 5-6 December 2012
F. Sottile (LSI, Ecole Polytechnique, Palaiseau), P. Romaniello (LPT, Université de Toulouse)
Numerical methods and mathematical approaches for solar devices
INRIA Paris – 5 september 2012
Ismaila Dabo (CERMICS), Virginie Ehrlacher (CERMICS); Gabriel Stoltz (CERMICS)
LPTCM, UPMC – Automn 2011 or early 2012
D. Borgis (ENS, Paris ), A. Perera (LPTMC, UPMC, Paris)
2011
Ecole Polytechnique – 5-6 December 2011
F. Sottile (LSI, Ecole Polytechnique, Palaiseau), P. Romaniello (LPT, Université de Toulouse)
Reaction-diffusion equations for modelling of transport in porous media
IHP – November 2011
B. Despres (LJLL-UPMC, Paris), M. JARDAT (PECSA-UPMC, Paris)
Brainstorm meeting on the development of next generation force fields
12-14 septembre 2011
P. Piquemal (University Paris 6, France), K. D. Jordan (University of Pittsburgh, USA)
Finite temperature orbital-free calculations for hot dense matter
30-31 mai 2011
F. Lambert (CEA/DAM/DIF), L. Collins (LANL, USA), J. Clerouin (CEA/DAM/DIF)
New insights on metals under extreme conditions
CEA Paris – 9-11 mai 2011
A. Dewaele (CEA/DAM/DIF), S. Bernard (CEA/DAM/DIF)
UPEMLV – 7 mars 2011
M. Hochlaf (UPEMLV), D. Lauvergnat (UPSud), R. Linguerri (UMLV)