This is the exaStamp software package, 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 is a high performance classical molecular dynamics simulation code 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. exaStamp 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.
exaStamp documentation can be accessed using the following QR code and URls (Website and Documentation git repository.
| Main sections of the documentation can be accessed directly using the following URLs |
|---|
| exaStamp background |
| Build and installation instructions |
| User guide |
| Beginner's guide |
| microStamp miniApp |
| References |
| About |
For more details, see CONTRIBUTING.md. Main guidelines are:
- For any bug, please create an issue and add the label “bug”. We welcome all feedback to make exaStamp as robust as possible.
- If you would like to participate and add functionality to exaStamp, you can find instructions for coding style, tests and pull request process in CONTRIBUTING.md.
- If you have any support-related / collaboration questions, please contact the team at paul.lafourcade@cea.fr. If you are a
CEAmember, please request access to the group : "exaNBody & Co. (exaStamp, exaDEM, exaSPH)", an external access can also be provided.
- Paul Lafourcade (CEA/DAM) (paul.lafourcade@cea.fr)
- Thierry Carrard (CEA/DAM)
- Raphaël Prat (CEA/DES)
- Claire Lemarchand (CEA/DAM)
See LICENSE.txt