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howto [2018/12/04 16:15] – [Basic Topics] 130.60.136.203howto [2018/12/04 16:17] – [Advanced Topics] 130.60.136.203
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   * [[howto:gethelp|How to ask a question on Google groups]]   * [[howto:gethelp|How to ask a question on Google groups]]
   * [[howto:gemc|How to run GEMC calculations]]   * [[howto:gemc|How to run GEMC calculations]]
-  * [[howto:kg|How to run KG calculations]]+
 ===== Advanced Topics ===== ===== Advanced Topics =====
   * [[https://brehm-research.de/spectroscopy|How to calculate vibrational spectra from AIMD]] with CP2K and [[http://www.travis-analyzer.de/|TRAVIS]] (Updated 2018).   * [[https://brehm-research.de/spectroscopy|How to calculate vibrational spectra from AIMD]] with CP2K and [[http://www.travis-analyzer.de/|TRAVIS]] (Updated 2018).
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   * [[howto:cdft|How to perform constrained DFT (CDFT) simulations]]   * [[howto:cdft|How to perform constrained DFT (CDFT) simulations]]
   * [[howto:pao-ml|How to run simulations with PAO-ML]]   * [[howto:pao-ml|How to run simulations with PAO-ML]]
 +  * [[howto:kg|How to run KG calculations]]
 ===== 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