Back to the main page of this manual | Input reference of CP2K version 5.1 (Revision svn:18091) |
&PW92 {Logical} | |
activates the functional | |
This keyword cannot be repeated and it expects precisely one logical. | |
The lone keyword behaves as a switch to .TRUE. | |
Default value: .FALSE. |
PARAMETRIZATION {Keyword} | |
Which one of parametrizations should be used | |
This keyword cannot be repeated and it expects precisely one keyword. | |
Default value: ORIGINAL | |
List of valid keywords:
|
SCALE {Real} | |
Scaling of the energy functional | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value: 1.00000000E+000 |
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