Back to the main page of this manual | Input reference of CP2K version 8.1 |
CP2K_INPUT /
FORCE_EVAL /
EMBED /
MAPPING /
FORCE_EVAL /
FRAGMENT
&FRAGMENT {Integer} |
|
Defines the index of the fragment defined | |
This keyword cannot be repeated and it expects precisely one integer. |
{Integer} {Integer} |
|
Starting and ending atomic index defining one fragment must be provided | |
This keyword cannot be repeated and it expects precisely 2 integers. |
MAP {Integer} |
|
Provides the index of the fragment of the MIXED force_eval mapped on the locally defined fragment. | |
This keyword cannot be repeated and it expects precisely one integer. |
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