Back to the main page of this manual | Input reference of CP2K version 8.2 |
CP2K_INPUT /
MOTION /
PINT /
HELIUM /
AVERAGES
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. |
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