Scientific Computing Core

CP2K development


Some research groups at CASUS employ condensed matter simulations. For that purpose, CASUS hosts a development group for CP2K. CP2K is a quantum-chemistry and solid-state physics software package capable of performing large-scale massively parallel calculations on different levels of theory.

Link to CASUS Software repository

  • Dr. Frederick Stein

    Scientific Computing Core
  • Dr. Johann Pototschnig

    Professional Support

  • Dr. Andreas Knüpfer

    Head of Scientific Computing Core