calculate_bs_along_emass_vecs (masses_dict, ...)
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check_soc (spin_band_dict)
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convert_key_to_tuple (key)
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create_columns_fnames (row)
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custom_table (values_dict, title)
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em (kpts_kv, eps_k[, bandtype, ndim])
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TODO: Do me. |
embands (gpw, soc, bandtype[, delta])
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Effective masses for bands within delta of extrema. |
evalmodel (kpts_kv, c_p[, thirdorder])
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fit (kpts_kv, eps_k[, thirdorder])
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get_2nd_order_extremum (c[, ndim])
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get_3rd_order_extremum (xm, ym, zm, c, ...[, ...])
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get_bt_ks (bandtype, k1_c, k2_c)
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get_emass_dict_from_row (row)
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get_extremum_type (dxx, dyy, dzz, dxy, dxz, dyz)
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get_gapskn (gpw[, fallback, soc])
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get_name (soc, bt)
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get_range (mass, _erange)
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get_vb_cb_indices (e_skn, efermi, delta)
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Find CB and VB within a distance of delta of the CB and VB extrema. |
kptsinsphere (cell_cv[, npoints, erange, m, ...])
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make_the_plots (row, *args)
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model (kpts_kv)
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Calculate simple third order model. |
nonsc_sphere ([gpw, fallback, soc, bandtype, ...])
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Non sc calculation for kpts in a sphere around the VBM/CBM. |
preliminary_refine ([gpw, soc, bandtype, ...])
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set_default (settings)
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unpack_masses (masses, soc, bt, results_dict)
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webpanel (result, row, key_descriptions)
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wideMAE (masses, bt, cell_cv[, erange])
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