_DEFAULT_KEYWORD_ | |
at_name rx ry rz at_index | |
The core coordinates in xyz format. | |
This optional keyword expects a string, and may repeat | |
UNIT | |
UNIT angstrom | |
Specify the unit of measurement for the coordinates in inputAll available CP2K units can be used. | |
This optional keyword expects a word. Default value: angstrom | |
SCALED | |
SCALED F | |
Specify if the coordinateds in input are scaled. | |
This optional keyword expects a logical | |
This keyword behaves as a switch T . Default value: F |