CONQUEST: Links
Other linear scaling DFT codes.
Siesta
OpenMX
BigDFT
ONETEP
MondoSCF
Other electronic structure groups and resources.
CMMP group at UCL
Computational Materials Science Centre, NIMS
Theoretical Chemistry group, ISM, Bordeaux
ARCHER UK HPC Facility
K supercomputer in Japan
Links:
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External Links:
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Recent News:
Roadmap on electronic structure codes in the exascale era
Hyper-parameters for machine learning forces
Multi-site support function review
Cobalt phosphide nanorod catalysts
Machine learning forces