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Poster: Planewave-Based First-Principles MD Calculation on 80, 000-node K-Computer.

Akiyoshi KurodaKazuo MinamiTakahiro YamasakiJun NaraJunichiro KogaTsuyoshi UdaTakahisa Ohno
Published in: SC Companion (2012)
Keyphrases
  • computer systems
  • computer technology
  • design principles
  • calculation method
  • databases
  • similarity measure
  • multi agent
  • artificial neural networks
  • probabilistic model
  • building blocks