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events:2018_summer_school:index [2018/06/18 14:40] – ibethuneevents:2018_summer_school:index [2020/08/21 10:15] (current) – external edit 127.0.0.1
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 ====== CP2K Summer School 2018 ====== ====== CP2K Summer School 2018 ======
 Material from the CP2K Summer School held at the [[https://www.hartree.stfc.ac.uk/Pages/home.aspx|Hartree Centre]], STFC Daresbury, 19th-22nd June 2018 is listed below. Material from the CP2K Summer School held at the [[https://www.hartree.stfc.ac.uk/Pages/home.aspx|Hartree Centre]], STFC Daresbury, 19th-22nd June 2018 is listed below.
 +
 +Group photo (click for full-size): {{events:2018_summer_school:group.jpg?300}}
  
 ===== Agenda & Slides ===== ===== Agenda & Slides =====
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  Tues 19th June  Tues 19th June
   * 12.00-13.30: Arrival & Registration   * 12.00-13.30: Arrival & Registration
-  * 13.30-15.00: Introduction to CP2K, Setting up computer accounts & running jobs - Iain Bethune +  * 13.30-15.00: Introduction to CP2K, Setting up computer accounts - Iain Bethune 
-    * {{events:2016_summer_school:cp2k_intro.pdf|Introduction and Overview of CP2K}}+    * {{events:2018_summer_school:cp2k_intro.pdf|Introduction and Overview of CP2K}}
     * {{events:2018_summer_school:cp2k_accounts.pdf|Setting up computer accounts}}     * {{events:2018_summer_school:cp2k_accounts.pdf|Setting up computer accounts}}
-    * {{events:2016_summer_school:running_cp2k_calculations.pdf|Running CP2K Calculations}} 
   * 15.00-15.30: Coffee Break   * 15.00-15.30: Coffee Break
-  * 15.30-17.00: Running CP2K calculations - Iain Bethune +  * 15.30-17.00: Running CP2K calculations, Intro to Exercises - Iain Bethune 
-    * {{events:2016_summer_school:cp2k_exercises.pdf|Introduction to Exercises}}, Iain Bethune+    * {{events:2018_summer_school:running_cp2k_calculations.pdf|Running CP2K Calculations}} 
 +    * {{events:2018_summer_school:cp2k_exercises.pdf|Introduction to Exercises}}
  
  
  Wed 20th June  Wed 20th June
-  * 9.00-10.30: Gaussian and (Augmented) Plane Waves Method: [[events:2016_summer_school:GPW|notes]], [[https://mattatlincoln.github.io/talks/cp2k_summerschool_2016/#/| slides]] - Matt Watkins+  * 9.00-10.30: Gaussian and (Augmented) Plane Waves Method - Matt Watkins 
 +    * [[https://mattatlincoln.github.io/talks/cp2k_summerschool_2016/#/|Slides]] 
 +    * [[events:2016_summer_school:GPW|Notes]]
   * 10.30-11.00: Coffee Break   * 10.30-11.00: Coffee Break
-  * 11.00-12.00: SCF Methods - Diagonalisation & Orbital Transformation:[[https://mattatlincoln.github.io/talks/cp2k_summerschool_2018/index.html#/|slides]], {{events:2016_summer_school:20160824_SCF.pdf|detailed notes}} - Matt Watkins+  * 11.00-12.00: SCF Methods - Diagonalisation & Orbital Transformation - Matt Watkins 
 +    * [[https://mattatlincoln.github.io/talks/cp2k_summerschool_2018/index.html#/|Slides]] 
 +    * {{events:2016_summer_school:20160824_SCF.pdf|Detailed notes}}
   * 12.00-13.00: Lunch Break   * 12.00-13.00: Lunch Break
   * 13.00-15.00: Lightning talks and poster session   * 13.00-15.00: Lightning talks and poster session
   * 15.00-15.30: Coffee Break   * 15.00-15.30: Coffee Break
-  * 15.30-17.00: {{events:2016_summer_school:cp2k_moving_atoms.pdf|Moving atoms - AIMD, geometry optimisation}} - Iain Bethune+  * 15.30-17.00: {{events:2018_summer_school:cp2k_moving_atoms.pdf|Moving atoms - AIMD, geometry optimisation}} - Iain Bethune
  
 Thu 21st June Thu 21st June
-  * 9.00-10.30: Hybrid Functionals and ADMM - Sanliang Ling+  * 9.00-10.30: {{events:2018_summer_school:cp2k-uk-stfc-june-2018-sanliang-ling.pdf|Hybrid Functionals/ADMM & Dispersion Corrections}} - Sanliang Ling
   * 10.30-11.00: Coffee Break   * 10.30-11.00: Coffee Break
-  * 11.00-12.00: {{events:2016_summer_school:cp2k_parallel.pdf|Parallel Performance}} - Iain Bethune+  * 11.00-12.00: Parallel Performance 
 +    * {{events:2018_summer_school:cp2k_parallel.pdf|Parallel Performance}} - Iain Bethune 
 +    * {{events:2018_summer_school:archer-prace-hpce.pdf|ARCHER, PRACE & HPC Europa}} - Arno Proeme
   * 12.00-13.00: Lunch Break   * 12.00-13.00: Lunch Break
-  * 13.00-15.00: {{events:2016_summer_school:building_cp2k.pdf|Building CP2K}} (optional) - Iain Bethune +  * 13.00-15.00: {{events:2018_summer_school:building_cp2k.pdf|Building CP2K}} (optional) - Iain Bethune 
   * 15.00-15.30: Coffee Break   * 15.00-15.30: Coffee Break
-  * 15.30-17.00: Exercises+  * 15.30-17.00: {{events:2018_summer_school:cp2k-workshop-benoit.pdf|Vibrational Analysis}} - David Benoit
  
-  * 19.30: Dinner at [[https://www.chefandbrewer.com/pubs/cheshire/ring-o-bells/|Ring O' Bells]], Daresbury Village ({{ringobellsmenu.pdf|Menu}}, [[https://goo.gl/forms/kmvQRKOuZLHRosPj2|Selection form]])+  * 19.30: Dinner at [[https://www.chefandbrewer.com/pubs/cheshire/ring-o-bells/|Ring O' Bells]], Daresbury Village ({{ringobellsmenu.pdf|Menu}}, [[https://goo.gl/forms/kmvQRKOuZLHRosPj2|Selection form]]), {{direct_route.pdf|Direct Route}}, {{scenic_route.pdf|Scenic Route}}
  
 Fri 22nd June Fri 22nd June
-  * 9.00-10.30: Advanced Topics+  * 9.00-10.30: Exercises
   * 10.30-11.00: Coffee Break   * 10.30-11.00: Coffee Break
   * 11.00-12.00: Exercises   * 11.00-12.00: Exercises
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