CP2K Open Source Molecular Dynamics

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howto [2024/02/24 10:08] – oschuetthowto [2024/02/24 10:11] – oschuett
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   * [[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).
   * [[https://brehm-research.de/bqb|Lossless compression of trajectories and Cube files - the bqb format]].   * [[https://brehm-research.de/bqb|Lossless compression of trajectories and Cube files - the bqb format]].
-  * [[howto:generate_manual| How to generate the input reference manual]] 
   * [[howto:pgo | How to build with profile guided optimization]]   * [[howto:pgo | How to build with profile guided optimization]]
   * [[howto:stm | How to generate STM images from CP2K simulation]]   * [[howto:stm | How to generate STM images from CP2K simulation]]
howto.txt · Last modified: 2024/02/24 10:14 by oschuett