| Back to the main page of this manual | Input reference of CP2K version 9.1 |
CP2K_INPUT /
FORCE_EVAL /
PROPERTIES /
TDDFPT /
XC /
XC_FUNCTIONAL /
MGGA_C_M11&MGGA_C_M11 {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 |
_A0 {Real} |
|
| a0 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
1.00000000E+000 |
_A1 {Real} |
|
| a1 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
0.00000000E+000 |
_A10 {Real} |
|
| a10 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-9.18410670E+000 |
_A11 {Real} |
|
| a11 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
0.00000000E+000 |
_A2 {Real} |
|
| a2 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-3.89332500E+000 |
_A3 {Real} |
|
| a3 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-2.16884550E+000 |
_A4 {Real} |
|
| a4 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
9.34972000E+000 |
_A5 {Real} |
|
| a5 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-1.98451400E+001 |
_A6 {Real} |
|
| a6 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
2.34552530E+000 |
_A7 {Real} |
|
| a7 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
7.92465130E+001 |
_A8 {Real} |
|
| a8 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
9.60427570E+000 |
_A9 {Real} |
|
| a9 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-6.78567190E+001 |
_B0 {Real} |
|
| b0 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
7.22397980E-001 |
_B1 {Real} |
|
| b1 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
4.37305640E-001 |
_B10 {Real} |
|
| b10 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-1.14598680E+002 |
_B11 {Real} |
|
| b11 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
0.00000000E+000 |
_B2 {Real} |
|
| b2 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-1.60888090E+001 |
_B3 {Real} |
|
| b3 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-6.55424370E+001 |
_B4 {Real} |
|
| b4 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
3.20572300E+001 |
_B5 {Real} |
|
| b5 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
1.86178880E+002 |
_B6 {Real} |
|
| b6 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
2.04834680E+001 |
_B7 {Real} |
|
| b7 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-7.08537390E+001 |
_B8 {Real} |
|
| b8 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
4.44839150E+001 |
_B9 {Real} |
|
| b9 | |
| This keyword cannot be repeated and it expects precisely one real. | |
Default value:
-9.44847470E+001 |
| Back to the main page of this manual or the CP2K home page | (Last update: 31.12.2021) |