Back to the main page of this manual | Input reference of CP2K version 9.1 |
CP2K_INPUT /
MOTION /
FREE_ENERGY /
METADYN /
METAVAR /
WALL /
GAUSSIAN
SIGMA {Real} |
|
Specify the width of the gaussian: WW*e^(-((CV-POS)/sigma)^2) | |
This keyword cannot be repeated and it expects precisely one real. | |
Default unit:
[internal_cp2k]
|
WW {Real} |
|
Specify the height of the gaussian: WW*e^(-((CV-POS)/sigma)^2) | |
This keyword cannot be repeated and it expects precisely one real. | |
Default unit:
[hartree]
|
Back to the main page of this manual or the CP2K home page | (Last update: 31.12.2021) |