Exact exchange relaxation runs PBE Prec Normal --------------- B.hR12 (2x2x2 supercell) k1: -6.658366 k2: -6.677015 k3: -6.677626 B.hR105 k1: -6.665926 = hR12 - 0.007560 k2: -6.653310 = hR12 + 0.023705 k3: -6.651913 = hR12 + 0.025713 B.hR141 k1: -6.675326 = hR12 - 0.016960 k2: -6.678635 = hR12 - 0.001620 k3: -6.678096 = hR12 - 0.000524 HSE06 Prec Normal ----------------- B.hR12 (2x2x2 supercell) k1: -7.699193 k2: -7.711786 k3: running B.hR105 k1: -7.702575 = hR12 - 0.003382 k2: -7.681777 = hR12 + 0.030009 B.hR141 k1: -7.718170 = hR12 - 0.018977 k2: -7.715665 = hR12 - 0.003879 HSE06 Prec Accurate ------------------- B.hR12 (2x2x2 supercell) k1: