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howto [2016/01/17 10:56] – tutorials renamed to howto oschuetthowto [2018/04/10 10:48] – [Installation] jglan
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 ====== HOWTOs ====== ====== HOWTOs ======
  
-Several [[events| CP2K tutorials]] have been held. Lectures and exercises from these are useful starting points.  In addition, several tutorials on specific aspects of using CP2K are below. +Please feel free to contribute a HOWTO pageclick [[howto:wiki|here]] for instructions.
- +
-Please feel free to contribute, and add to the list of tutorials on this page. Click [[howto:wiki|here]] for instructions on how to add new tutorials.+
  
 ===== Installation ===== ===== Installation =====
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   * [[howto:install_with_plumed|How to Compile and Install CP2K with PLUMED]]   * [[howto:install_with_plumed|How to Compile and Install CP2K with PLUMED]]
   * [[howto:compile_on_windows_with_cygwin|How to Compile and Install CP2K on Windows with Cygwin]]   * [[howto:compile_on_windows_with_cygwin|How to Compile and Install CP2K on Windows with Cygwin]]
 +  * [[howto:compile_on_mac|How to Compile and Install CP2K on Mac]]
 ===== Basic Topics ===== ===== Basic Topics =====
   * [[howto:wiki|How to use the Wiki]]   * [[howto:wiki|How to use the Wiki]]
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   * [[howto:stm | How to generate STM images from CP2K simulation]]   * [[howto:stm | How to generate STM images from CP2K simulation]]
   * [[howto:resp | How to fit RESP charges in CP2K]]   * [[howto:resp | How to fit RESP charges in CP2K]]
 +  * [[howto:cp2k_omen | How to perform DFT+NEGF transport calculations with CP2K and OMEN]]
 +  * [[howto:lrigpw | How to run DFT with local resolution-of-the-identity in CP2K]]
 +  * [[howto:biochem_qmmm|How to run QM/MM simulations for biochemical systems]]
 +  * [[howto:ic-qmmm| How to run IC-QM/MM simulations for interface systems]]
 +  * [[howto:shifter|How run with Shifter / Docker]]
 +  * [[howto:cdft|How to perform constrained DFT simulations]]
 +  * [[howto:pao-ml|How to run simulations with PAO-ML]]
 ===== Applications / Case Studies ===== ===== Applications / Case Studies =====
   * [[ science | Example published work using CP2K ]]   * [[ science | Example published work using CP2K ]]
      
howto.txt · Last modified: 2024/02/24 10:14 by oschuett