The CP2K project : input section SHELL_VELOCITY

Section SHELL_VELOCITY

Index of all sections. This section is located at __ROOT__%FORCE_EVAL%SUBSYS%SHELL_VELOCITY.

The velocities of shells for shell-model potentials, in xyz format. This section can not be repeated and can not be optional.

Subsections

None

Section keywords

Keyword descriptions

_DEFAULT_KEYWORD_
The shell velocities in xyz format. The same order as the shell coordinate is assumed.
This required keyword expects precisely 3 reals, and may repeat


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