Back to the main page of this manual | Input reference of CP2K version 9.1 |
CP2K_INPUT /
FORCE_EVAL /
DFT /
KG_METHOD /
XC /
XC_FUNCTIONAL /
MGGA_X_RSCAN
&MGGA_X_RSCAN {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 {Real} |
|
Scales this functional | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value:
1.00000000E+000 |
_ALPHAR {Real} |
|
alphar parameter | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value:
1.00000000E-003 |
_C2 {Real} |
|
c2 parameter | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value:
8.00000000E-001 |
_D {Real} |
|
d parameter | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value:
1.24000000E+000 |
_K1 {Real} |
|
k1 parameter | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value:
6.50000000E-002 |
_TAUR {Real} |
|
taur parameter | |
This keyword cannot be repeated and it expects precisely one real. | |
Default value:
1.00000000E-004 |
Back to the main page of this manual or the CP2K home page | (Last update: 31.12.2021) |