vibeqc.density_of_states_hcore

vibeqc.density_of_states_hcore(system, basis, mesh, *, sigma=0.01, n_grid=401, pad=5.0, lattice_opts=None, n_electrons_per_cell=None)

Non-interacting DOS for a system on a Monkhorst–Pack mesh. Convenience for quick band-structure overviews.

Parameters:

• system (vibeqc._vibeqc_core.PeriodicSystem)

• basis (vibeqc._vibeqc_core.BasisSet)

• mesh (Sequence[int])

• sigma (float)

• n_grid (int)

• pad (float)

• lattice_opts (vibeqc._vibeqc_core.LatticeSumOptions | None)

• n_electrons_per_cell (int | None)

Return type:

DensityOfStates