Back to the main page of this manual | Input reference of CP2K version 5.1 (Revision svn:18091) |
&XALPHA {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. |
SCALE_X {Real} | |
scales the exchange part of the functional | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value: 1.00000000E+000 |
XA {Real} | |
Value of the xa parameter (this does not change the exponent, just the mixing) | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value: 6.66666667E-001 |
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