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--- exercises:code_structure [2022/09/08 12:41] – created jglan
+++ exercises:code_structure [2022/09/08 12:42] (current) – removed jglan
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-The input of CP2K is well-organized using the following structure. One can follow the [[https://manual.cp2k.org/|CP2K Manual]] to tailor the input.
-Each section is initialized by **&SECTION** and closed by **&END SECTION**. Within a **SECTION**, one has the freedom to give the **PARAMETER** to the **KEYWORD** within this **SECTION**.
-<code>
-&SECTION
-   KEYWORD PARAMETER
-   &SUB_SECTION
-      KEYWORD PARAMETER
-   &END SUB_SECTION
-&END SECTION
-</code>
-For example, within the **GLOBAL** section, **PROJECT** reads **H2O** as the project name, which will give the prefix of the printout files. **RUN_TYPE** reads **ENERGY** to carry out single-point energy calculations.
-<code>
-&GLOBAL
-  PROJECT H2O
-  RUN_TYPE ENERGY
-&END GLOBAL
-</code>