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EuroHPC Summit Week 2022

Mar 22 – 24, 2022
Europe/Brussels timezone

Session

HPC for challenging applications: material science

108
Mar 23, 2022, 2:30 PM

Conveners

HPC for challenging applications: material science

  • Matthieu Salanne

Presentation materials

  1. 96. Generating a FAIR crystal-structure database with the AiiDA informatics infrastructure
    Marnik Bercx (Swiss Federal Institute of Technology Lausanne (EPFL))
    3/23/22, 2:30 PM
  2. 97. Quantum phase diagram of high-pressure hydrogen with GPU-accelerated quantum Monte Carlo simulations
    Michele Casula (Sorbonne University)
    3/23/22, 2:48 PM
  3. 98. Quantum ESPRESSO on GPU: accelerating a complex code combining performance with portability
    Ivan Carnimeo (International School for Advanced Studies (SISSA))
    3/23/22, 3:06 PM
  4. 99. Large scale electronic structure simulations of complex magnetic objects
    Daniel Wortmann (Research Center Jülich)
    3/23/22, 3:24 PM
  5. 100. Massively Parallel Coupled Cluster Theory For Material Science
    Andreas Irmler (Technical University Vienna)
    3/23/22, 3:42 PM
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