About exaStamp¶

Project summary¶

exaStamp is a high performance molecular dynamics simulation code, originated at CEA/DAM. exaStamp stands for Simulations Temporelles Atomistiques et Moléculaires Parallèles à l'exascale (in French) or exascale Simulations of Time-dependent Atomistic and Molecular systems in Parallel (in English). This software is distributed under the Apache 2.0 public license.

exaStamp dependes on the exaNBody framework[@exanbody] and is designed to run efficiently on supercomputers as well as laptops or workstations. It takes advantage of hybrid parallelism with the ability to run using MPI + X where X is either OpenMP or Cuda/HIP. This code is the result of a long-time effort at CEA/DAM/DIF, France. It is an open-source code, distributed freely under the terms of the Apache Public License version 2.0.

Contributors¶

Development team
- Paul Lafourcade
- Thierry Carrard
- Raphaël Prat
- Emmanuel Cieren
- Estelle Dirand
Scientific team
- Laurent Soulard
- Claire Lemarchand
- Nicolas Pineau
- Jean-Bernard Maillet
- Christophe Denoual
Students
- Guillaume Ewald
- Eleonore Duval
- Eliott Dubois
- Killian Babilotte
- Aude Giard
- Gerome Faure
- Guillaume Chevrot

License¶

exaStamp is licensed under the Apache License, Version 2.0 (Apache-2.0).

See LICENSE for details.

Contact¶

Use the Github discussions to suggest new features, discuss ideas, check annoucements or show what you're doing with the code.

In addition, if you identify a malfuncton or a bug, please feel free to open an issue or discussion on Github.