CP2K Open Source Molecular Dynamics

User Tools

Site Tools

Trace:
howto:resp

Differences

This shows you the differences between two versions of the page.

Link to this comparison view

Both sides previous revisionPrevious revision
Next revision		Previous revision
Next revisionBoth sides next revision
howto:resp [2015/12/04 15:05] – use special INP-links oschuetthowto:resp [2015/12/08 10:16] – [Nonperiodic fitting] dgolze
Line 16: Line 16:
 \end{equation} \end{equation}
 For more details see: For more details see:
-* [[doi>10.1021/j100142a004 | J. Phys. Chem., 97 , 10269-10280 (1993).]]+ [[doi>10.1021/j100142a004 | J. Phys. Chem., 97 , 10269-10280 (1993).]]
  
 ==== Periodic fitting ==== ==== Periodic fitting ====
Line 218: Line 218:
    * Metal-organic framework IRMOF-1 - periodic fit using REPEAT : {{:howto:irmof-1_REPEAT.tar.gz|irmof-1_REPEAT.tar.gz}}\\    * Metal-organic framework IRMOF-1 - periodic fit using REPEAT : {{:howto:irmof-1_REPEAT.tar.gz|irmof-1_REPEAT.tar.gz}}\\
    * Metal-organic framework MIL-53-Al - periodic fit using REPEAT: {{:howto:mil-53-al-repeat.tar.gz|mil-53-al-repeat.tar.gz}}\\    * Metal-organic framework MIL-53-Al - periodic fit using REPEAT: {{:howto:mil-53-al-repeat.tar.gz|mil-53-al-repeat.tar.gz}}\\
-   * Graphene on Ru(0001) - periodic fit:+   * Graphene on Ru(0001) - periodic fit: {{:howto:graphene_Ru.tar.gz|graphene_Ru.tar.gz}}
howto/resp.txt · Last modified: 2024/01/15 09:24 by oschuett