NOMAD Centre of Excellence
Bringing computational materials science to exascale
Exascale Codes
- Bringing DFT, Green-function methods, and coupled-cluster theory to exascale
- Supporting entire code families, covering planewaves (PW), linearized augmented PWs, and atom-centred orbitals
- Follow us on GitHub
Exascale Workflows
- Enabling exascale computations by advanced workflows
- Covering high-throughput computations and beyond-DFT workflows
- Learn how to work with ASE/ASR and FireWorks in this tutorial
Extreme-scale data
- Advance the NOMAD AI toolkit and bring it towards near-real-time performance
- Like to visit the NOMAD Laboratory and its services for up- and downloading, and exploring materials data?
- Watch our video tutorials to learn how to work with the AI toolkit