If this variable is present, the ions will have initial velocities
velocities to the atoms following a Boltzmann distribution with
this temperature (in Kelvin). Used only if TDDynamics = Ehrenfest
and MoveIons = yes.
Specifies the highest angular momentum for each atom type. All orbitals up
to that angular momentum will be included in the calculation.
Possible values for the angular momenta are s, p, d, f.
These are examples: