News
EMC2@Roscoff’24
Date: 1-5 July 2024 Location: Roscoff Programme Monday morning (July 1st)Accueil-IntroductionAndreas Savin : A modified expression for the Hamiltonian expectation value exploiting the short-range behavior of the wave functionMuhammad Hassan : Analysis of the Single...
5th edition of the Mini-school on mathematics for theoretical chemistry and physics
(organized by GDR NBODY with support from CNRS INC, LCT, LJLL, and ERC EMC2) Date: 5-7 June 2023 Location: Sorbonne Université, Pierre et Marie Curie (or Jussieu) campus, 4 place Jussieu, 75005, Paris. Laboratoire Jacques-Louis Lions, tower/corridor 15-16, 3rd floor,...
Colloquium Jacques-Louis Lions
Jack Dongarra 2021 ACM A.M. Turing Award Laureate The University of Tennessee, Oak Ridge National Laboratory & University of Manchester An Overview of High Performance Computing and Future Requirements 6 June 2023, from 14:00 to 15:00 CEST Amphithéâtre 24, tour...
DFTK school 2022: Numerical methods for density-functional theory simulations
DFTK school 29 to 31 Aug 2022 The DFTK school 2022 will take place from 29 to 31 Aug 2022 at Sorbonne Université, Paris and invites researchers interested in the numerical and mathematical background of electronic-structure simulations as well...
Online Workshop EMC2
Online Workshop EMC2 Monday to Wednesday 01-03/02/2021 Organizers: Eric Cancès (Ecole des Ponts and Inria Paris), Laura Grigori (Inria Paris and Sorbonne University), Yvon Maday (Sorbonne University), Jean-Philip Piquemal (Sorbonne University) Benedetta Mennucci...
Presentation by Pierre Monmarché
On July 3rd, 2020, at 3:30 pm Velocity jumps: an alternative to multi-time step integrators. Abstract: Simulating motion of nuclei (following e.g. the Langevin dynamics) requires to compute forces at each time-step, which is numerically demanding. The goal of a...
Presentation by Michael F. Herbst
On June 26, 2020, at 3:30 pm Insight-driven design of novel SCF preconditioning strategies for mixed systems: A DFTK case-study. Abstract: Progress in density-functional theory is often the outcome of efforts involving physically sound approximate models,...
Michael Herbst, Programming Language Julia day.
Julia day at Jussieu After some requests from people at Jussieu and CERMICS, there will be a day about the programming language Julia day at Jussieu on 13th December 2019. For details see Time and location. I'll also post the teaching material right here. Everybody's...
Conference Horizon Maths 2019 “Mathématiques & Chimie”
Mathématiques et Chimie L'édition 2019 d'Horizon Maths a eu lieu le mardi 3 décembre 2019 de 9h à 17h dans l'amphithéâtre Charpak de Sorbonne Université (4, place Jussieu, Paris 5e). Horizon Maths 2019 avait pour thème Mathématiques et Chimie, abordé sous la forme de...
Kick-off meeting EMC2
The project EMC2 Monday to Wednesday 07-09/10/2019 Molecular simulation is one of the most dynamic areas of scientific computing. Its field of application is very broad, ranging from theoretical chemistry and drug design to materials science and nanotechnology....