ATOM_PARAMETER

Section can be repeated.

Section used to specify a atom parameter set for xTB calclulations. [Edit on GitHub]

Keywords

DEFAULT_KEYWORD

Keyword descriptions

DEFAULT_KEYWORD: string

Keyword can be repeated.

xTB atom parameters in standard format

Element symbol  eta  gamma alpha Zeff label kpoly kappa Hen zeta
nshell repeat the following block of lines)
label kpoly kappa Hen zeta [[Edit on GitHub](https://github.com/cp2k/cp2k/blob/master/src/input_cp2k_tb.F#L509)]