triqs_dft_tools.converters.wannier90.read_misc_input
- triqs_dft_tools.converters.wannier90.read_misc_input(w90_seed, n_spin_blocks, n_k)[source]
Reads input from DFT code calculations to get occupations, the band window, the Fermi energy and the basis for the k points.
- Parameters:
- w90_seedstring
seed of wannier90 calculations
- n_spin_blocksint
SP + 1 - SO
- n_kint
Number of k points
- Returns:
- fermi_weightsnp.ndarray[n_k, n_spin_blocks, n_bands]
occupations from DFT calculation
- band_windownp.ndarray[n_k, n_spin_blocks, n_bands]
band indices of correlated subspace
- fermi_energyfloat
the DFT Kohn-Sham Fermi energy
- kpt_basis: np.ndarray[3, 3]
the basis vectors in reciprocal space