Back to the main page of this manual | Input reference of CP2K version 6.1 |
LIST {Integer} ... or a range {Integer}..{Integer} | |
Specifies a list of atoms. | |
This keyword can be repeated and it expects a list of integers. |
MOLNAME {Word} ... | |
Specifies a list of named molecular fragments. | |
This keyword can be repeated and it expects a list of words. |
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