Back to the main page of this manual | Input reference of CP2K version 2.5.1 (Revision svn:13632) |
ATOM {Word} | |
Defines the atomic kind for this damping function. | |
This keyword cannot be repeated and it expects precisely one word. |
BIJ {Real} | |
Defines the BIJ parameter for this damping. | |
This keyword cannot be repeated and it expects precisely one real. | |
Default unit: [angstrom^-1] |
CIJ {Real} | |
Defines the CIJ parameter for this damping. | |
This keyword cannot be repeated and it expects precisely one real. |
ORDER {Integer} | |
Defines the order for this damping. | |
This keyword cannot be repeated and it expects precisely one integer. | |
Default value: 3 |
TYPE {Word} | |
Defines the damping type. | |
This keyword cannot be repeated and it expects precisely one word. | |
Default value: TANG-TOENNIES |
Back to the main page of this manual or the CP2K home page | (Last update: 29.10.2015) |