Back to the main page of this manual | Input reference of CP2K version 6.1 (Revision svn:18464) |
IWEIGHT {Integer} | |
Weight for the restarted quantities (number of MC steps used to calculate the accumulated averages) | |
This keyword cannot be repeated and it expects precisely one integer. | |
Default value: 0 |
MOMENT_OF_INERTIA {Real} ... | |
Moment of inertia vector for all environments | |
This keyword can be repeated and it expects a list of reals. |
PROJECTED_AREA {Real} ... | |
Projected area vector for all environments | |
This keyword can be repeated and it expects a list of reals. |
PROJECTED_AREA_2 {Real} ... | |
Projected area vector squared for all environments | |
This keyword can be repeated and it expects a list of reals. |
RDF {Real} ... | |
Radial distributions averaged over all environments | |
This keyword can be repeated and it expects a list of reals. |
RHO {Real} ... | |
Spatial distributions averaged over all environments | |
This keyword can be repeated and it expects a list of reals. |
WINDING_NUMBER_2 {Real} ... | |
Winding number vector squared for all environments | |
This keyword can be repeated and it expects a list of reals. |
Back to the main page of this manual or the CP2K home page | (Last update: 12.6.2018) |