CP2K Open Source Molecular Dynamics

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version_history [2019/12/23 14:18] – [Trunk (7.0, development)] oschuettversion_history [2019/12/23 20:48] – [Trunk (7.0, development)] oschuett
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 Features available or under development in the latest git version (https://github.com/cp2k/cp2k) Features available or under development in the latest git version (https://github.com/cp2k/cp2k)
  
-  * SIRIUS: Plane Wave module with GPU support, see also [[howto:running_qe_computation | this tutorial]] for Quantum ESPRESSO users.+  * [[https://github.com/electronic-structure/SIRIUS | SIRIUS]]: Plane Wave module with GPU support, see also [[howto:running_qe_computation | this tutorial]] for Quantum ESPRESSO users.
   * xTB: Tight-binding module based on [[doi>10.1021/acs.jctc.7b00118]]   * xTB: Tight-binding module based on [[doi>10.1021/acs.jctc.7b00118]]
   * RPA / GW / MP2: migrated to DBCSR tensors.   * RPA / GW / MP2: migrated to DBCSR tensors.
version_history.txt · Last modified: 2024/01/10 13:26 by oschuett