CP2K Open Source Molecular Dynamics

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version_history [2019/12/23 20:48] – [Trunk (7.0, development)] oschuettversion_history [2019/12/24 09:01] – oschuett
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 Here you can see which new features / functionality are available in the released versions of CP2K Here you can see which new features / functionality are available in the released versions of CP2K
  
-===== Trunk (7.0, development) ===== +===== Trunk (8.0, development) =====
 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)
  
-  * [[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.+===== 7.1 ===== 
 + 
 +== Released December 24, 2019 == 
 +  * [[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.
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   * Updated libraries: DBCSR, ELPA, libint, libxc, libxsmm.   * Updated libraries: DBCSR, ELPA, libint, libxc, libxsmm.
   * Development moved from SVN to Git   * Development moved from SVN to Git
 +
 ===== 6.1 ===== ===== 6.1 =====
  
version_history.txt · Last modified: 2024/01/10 13:26 by oschuett