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Supercomputing Centre (BSC-CNS), and in coordination with the developers of the other MaX flagship codes, a shell of leading European HPC centres, and selected European private-sector technological partners
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founding and hosting member of the former European HPC infrastructure PRACE (Partnership for Advanced Computing in Europe), and is now hosting entity for EuroHPC JU, the Joint Undertaking that leads large
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. Integration & automation: connect the optimiser to existing simulation pipelines (DFT → TB/Wannier → transport), ensure provenance and reproducibility, and scale runs on Linux/HPC. Benchmarking & ablations: set
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hosting member of the former European HPC infrastructure PRACE (Partnership for Advanced Computing in Europe), and is now hosting entity for EuroHPC JU, the Joint Undertaking that leads large-scale
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inception in 2015. The Theory and Simulation Group participates in HANAMI (HPC Alliance for Applications and Supercomputing Innovation: the Europe - Japan collaboration). HANAMI is three-year-long
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(git, testing). Comfortable with Linux/HPC environments. Nice-to-have: Experience with equivariant GNNs (e.g., E(3)-equivariance), MACE or related message-passing models. Familiarity with Wannierisation