{
    "workflow": {
        "task": "wannierize",
        "functional": "ki",
        "method": "dscf",
        "mp_correction": false,
        "init_orbitals": "mlwfs",
        "alpha_guess": 0.077,
        "orbital_groups": [0, 0, 0, 0, 1, 1, 1, 1],
        "pseudo_library": "PseudoDojo/0.4/LDA/SR/standard/upf",
        "calculate_bands": true
    },
    "engine": {
        "from_scratch": true,
        "commands": {
            "pw": {
                "npool": 4
            }
        }
    },
    "atoms": {
        "cell_parameters": {
            "periodic": true,
            "ibrav": 2,
            "celldms": {"1": 10.2622}
        },
        "atomic_positions": {
            "units": "crystal",
            "positions": [["Si", 0.00, 0.00, 0.00],
                          ["Si", 0.25, 0.25, 0.25]]
        }
    },
    "kpoints": {
        "grid": [2, 2, 2],
        "offset": [0, 0, 0],
        "path": "LGXKG"
    },
    "calculator_parameters": {
        "ecutwfc": 60.0,
        "pw": {
            "system": {
                "nbnd": 20
            }
        },
        "w90": {
            "bands_plot": true,
            "projections": [[{"fractional_site": [ 0.25, 0.25, 0.25 ], "ang_mtm": "sp3"}],
                            [{"fractional_site": [ 0.25, 0.25, 0.25 ], "ang_mtm": "sp3"}]],
            "dis_froz_max": 10.6,
            "dis_win_max": 16.9
        },
        "ui": {
            "smooth_int_factor": 4
        }
    },
    "plotting": {
        "Emin": -15,
        "Emax": 10,
        "degauss": 0.2
    }
}
