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exercises:2015_cecam_tutorial:index [2015/08/31 19:37] ibethuneexercises:2015_cecam_tutorial:index [2020/08/21 10:15] (current) – external edit 127.0.0.1
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-====== Introduction ====== +====== Exercises of the 4th CP2K tutorial ====== 
- +The 4th CP2K Tutorial was held from August 31, 2015 to September 4, 2015 at ETH Zürich.\\ 
-====== Complete list of exercises ======+More information can be found on the **[[http://www.cecam.org/workshop-1122.html|CECAM event page]]**. 
 +Besides the exercises listed below, there were also **[[events:2015_cecam_tutorial:index|Talks]]**.
  
   * [[mtd1|Simple metadynamics simulation using the coordination numbers as variables]]   * [[mtd1|Simple metadynamics simulation using the coordination numbers as variables]]
   * [[urea|QM/MM study of UREA Zwitterion in water]]   * [[urea|QM/MM study of UREA Zwitterion in water]]
   * [[neb|Nanostructures and adsorption on metallic surfaces]]   * [[neb|Nanostructures and adsorption on metallic surfaces]]
 +  * [[forcefields|Setting up a FIST calculation of a protein using VMD]]
  
 Input files for all of the above can be downloaded from [[http://www.epcc.ed.ac.uk/~ibethune/files/CP2K_CECAM.tar.gz]] (1.8 GB!) Input files for all of the above can be downloaded from [[http://www.epcc.ed.ac.uk/~ibethune/files/CP2K_CECAM.tar.gz]] (1.8 GB!)
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 More exercises: More exercises:
  
 +  * [[geometry_and_cell_optimization|Geometry and cell optimization]]
   * [[exercises:2015_pitt:aimd|Ab initio MD]]   * [[exercises:2015_pitt:aimd|Ab initio MD]]
   * [[exercises:2015_pitt:mp2|MP2 and RPA]]   * [[exercises:2015_pitt:mp2|MP2 and RPA]]
   * [[exercises:2015_pitt:ls|Linear Scaling Simulations]]   * [[exercises:2015_pitt:ls|Linear Scaling Simulations]]
 +  * [[basis_set_optimisation_using_optimize_basis|Basis set optimisation using OPTIMIZE_BASIS]]
 +
exercises/2015_cecam_tutorial/index.1441049868.txt.gz · Last modified: 2020/08/21 10:14 (external edit)