hse

Full name: ase2sprkkr.asr.hse

Module class hierarchy

Inheritance diagram of ase2sprkkr.asr.hse.Result

Description

HSE band structure.

Functions

MP_interpolate(calc, delta_skn, lb, ub)

Interpolate corrections to band patch.

bs_hse(row[, filename, figsize, fontsize, ...])

get_kpts_size(atoms, kptdensity)

Find reasonable monkhorst-pack size which hits high symmetry points.

hse(kptdensity, emptybands)

hse_spinorbit(dct, calc)

webpanel(result, row, key_descriptions)

Classes

Result(cbm_hse, efermi_hse_soc, kcbm_nosoc, ...)