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version_history [2018/06/12 07:23] – [6.1] 130.60.136.207version_history [2019/08/07 15:41] – [6.1] vondele
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 ===== Trunk (7.0, development) ===== ===== Trunk (7.0, development) =====
  
-Features available or under development in the latest SVN version+Features available or under development in the latest git version (https://github.com/cp2k/cp2k)
  
 ===== 6.1 ===== ===== 6.1 =====
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   * Projection-operator adiabatization (POD) method   * Projection-operator adiabatization (POD) method
 +  * CP2K can now do Plane Wave (PW_DFT) calculations on CPU and GPU based on SIRIUS.
   * Include NVIDIA P100 kernels for DBCSR   * Include NVIDIA P100 kernels for DBCSR
 +  * Update toolchain
 +  * Prevent ELPA diagonalization crashes with small matrices and/or large core counts
 +  * Faster routines for reading and writing cube files using MPI I/O
 +  * Docker based tests
  
 ===== 5.1 ===== ===== 5.1 =====
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   * Maximum Overlap Method (MOM)   * Maximum Overlap Method (MOM)
   * Modified Atomic Orbitals (MAO) Analysis   * Modified Atomic Orbitals (MAO) Analysis
-  * Easier installation with an improved [[src>cp2k/tools/toolchain/install_cp2k_toolchain.sh|toolchain]]+  * Easier installation with an improved [[src>tools/toolchain/install_cp2k_toolchain.sh|toolchain]]
   * Improved Development Tools: [[dev:formattingconventions|prettifier]], [[https://apidoc.cp2k.org|API documentation]]   * Improved Development Tools: [[dev:formattingconventions|prettifier]], [[https://apidoc.cp2k.org|API documentation]]
   * Improved [[dev:codingconventions|Coding Standards]]   * Improved [[dev:codingconventions|Coding Standards]]
   * More collective variables   * More collective variables
   * [[howto:cp2k_omen|Transport with Omen:]] improvements   * [[howto:cp2k_omen|Transport with Omen:]] improvements
-  * [[src>cp2k/src/start/libcp2k.h|libcp2k.h]] interface (C/C++ header) +  * [[src>src/start/libcp2k.h|libcp2k.h]] interface (C/C++ header) 
   * Remote Memory Access (RMA) for future architectures   * Remote Memory Access (RMA) for future architectures
   * Various performance improvements and bug fixes   * Various performance improvements and bug fixes
version_history.txt · Last modified: 2024/01/10 13:26 by oschuett