CP2K Open Source Molecular Dynamics

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exercises:2018_uol_school:converging_cutoff [2018/05/31 14:43] – [Input files] mwatkinsexercises:2018_uol_school:converging_cutoff [2018/05/31 14:44] – [Input files] mwatkins
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 This exercise is similar to the previous one, but uses a setup and system more typical of CP2K usage. We will use a system of 32 H<sub>2</sub>O water molecules within a periodic box. Here is the input template: This exercise is similar to the previous one, but uses a setup and system more typical of CP2K usage. We will use a system of 32 H<sub>2</sub>O water molecules within a periodic box. Here is the input template:
  
-<code cp2k>+<code cp2k input_template.inp>
 &GLOBAL &GLOBAL
   PRINT_LEVEL MEDIUM   PRINT_LEVEL MEDIUM
events/2018_summer_school/converging_cutoff.txt · Last modified: 2020/08/21 10:15 by 127.0.0.1