host_material string | host_element_a string | host_element_b string | impurity string | removed_element string | site_type string | site string | is_a_latt int64 | is_interstitial int64 | is_interstitial_a int64 | is_interstitial_b int64 | is_interstitial_n int64 | M_Al int64 | M_As int64 | M_Cd int64 | M_Ga int64 | M_In int64 | M_P int64 | M_S int64 | M_Sb int64 | M_Se int64 | M_Te int64 | M_i_Cd_site int64 | M_i_S_site int64 | M_i_Se_site int64 | M_i_Te_site int64 | M_i_neut_site int64 | charge_from int64 | charge_to int64 | host bandgap_[eV] float64 | host lattice constant_[Ang.] float64 | host_epsilon float64 | ba_shift float64 | mba_pbe float64 | mba_pbe_gapfrac float64 | pbe defect level (relative to VBM)_[eV] float64 | hse defect level (relative to VBM)_[eV] float64 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.52 | 5.44 | 9.8 | 0.65834 | -1.53506 | -0.609151 | -1.61456 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.52 | 5.44 | 9.8 | 0.65834 | -1.16412 | -0.461952 | -1.28918 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.52 | 5.44 | 9.8 | 0.65834 | -0.75936 | -0.301333 | -0.93412 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.52 | 5.44 | 9.8 | 0.65834 | 0.9069 | 0.359881 | 0.52751 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.52 | 5.44 | 9.8 | 0.65834 | 1.4365 | 0.57004 | 0.99207 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.52 | 5.44 | 9.8 | 0.65834 | 2.37522 | 0.942548 | 1.81551 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.52 | 5.44 | 9.8 | 0.65834 | 2.77845 | 1.10256 | 2.16922 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.14925 | 1.249702 | 2.49447 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.5145 | 1.394643 | 2.81492 | null |
AlP | Al | P | P | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.8792 | 1.539365 | 3.1348 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.52 | 5.44 | 9.8 | 0.65834 | -1.32112 | -0.524254 | -1.42689 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.52 | 5.44 | 9.8 | 0.65834 | -0.9519 | -0.377738 | -1.10302 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.52 | 5.44 | 9.8 | 0.65834 | -0.55196 | -0.219032 | -0.75219 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.52 | 5.44 | 9.8 | 0.65834 | 0.65013 | 0.257988 | 0.30227 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.52 | 5.44 | 9.8 | 0.65834 | 1.32151 | 0.524409 | 0.8912 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.52 | 5.44 | 9.8 | 0.65834 | 2.58194 | 1.024579 | 1.99684 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.52 | 5.44 | 9.8 | 0.65834 | 2.97264 | 1.179619 | 2.33956 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.34574 | 1.327675 | 2.66683 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.6862 | 1.462778 | 2.96549 | null |
AlP | Al | P | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.52 | 5.44 | 9.8 | 0.65834 | 4.0492 | 1.606825 | 3.2839 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.52 | 5.44 | 9.8 | 0.65834 | -1.21468 | -0.482016 | -1.33353 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.52 | 5.44 | 9.8 | 0.65834 | -0.69726 | -0.27669 | -0.87965 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.52 | 5.44 | 9.8 | 0.65834 | -0.27299 | -0.108329 | -0.50748 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.52 | 5.44 | 9.8 | 0.65834 | 0.17128 | 0.067968 | -0.11777 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.52 | 5.44 | 9.8 | 0.65834 | 0.63971 | 0.253853 | 0.29313 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.52 | 5.44 | 9.8 | 0.65834 | 2.52953 | 1.003782 | 1.95087 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.52 | 5.44 | 9.8 | 0.65834 | 2.86056 | 1.135143 | 2.24124 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.27055 | 1.297837 | 2.60091 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.52 | 5.44 | 9.8 | 0.65834 | 3.6998 | 1.468175 | 2.97742 | null |
AlP | Al | P | Bi | P | 5 | M_P | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.52 | 5.44 | 9.8 | 0.65834 | 4.1014 | 1.62754 | 3.3297 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.24 | 5.64 | 10.06 | 0.623364 | -1.25288 | -0.559321 | -1.37074 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.72935 | -0.325603 | -0.91151 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.35063 | -0.156531 | -0.57929 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.24 | 5.64 | 10.06 | 0.623364 | 0.2549 | 0.113795 | -0.04813 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.24 | 5.64 | 10.06 | 0.623364 | 0.6801 | 0.303616 | 0.32486 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.24 | 5.64 | 10.06 | 0.623364 | 1.13345 | 0.506004 | 0.72253 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.24 | 5.64 | 10.06 | 0.623364 | 1.67397 | 0.747308 | 1.19667 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.95263 | 1.318138 | 2.31831 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.3228 | 1.483393 | 2.64304 | null |
AlAs | Al | As | Al | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.6411 | 1.625491 | 2.9222 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.24 | 5.64 | 10.06 | 0.623364 | -1.47278 | -0.657491 | -1.56363 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.24 | 5.64 | 10.06 | 0.623364 | -1.06231 | -0.474246 | -1.20358 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.64831 | -0.289424 | -0.84041 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.24 | 5.64 | 10.06 | 0.623364 | 0.2882 | 0.128661 | -0.01892 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.24 | 5.64 | 10.06 | 0.623364 | 0.89709 | 0.400487 | 0.5152 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.22759 | 0.99446 | 1.6823 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.59988 | 1.160661 | 2.00888 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.95054 | 1.317205 | 2.31646 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.2794 | 1.464018 | 2.60497 | null |
AlAs | Al | As | As | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.6129 | 1.612902 | 2.8975 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.24 | 5.64 | 10.06 | 0.623364 | -1.36799 | -0.61071 | -1.47171 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.94923 | -0.423763 | -1.10438 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.53618 | -0.239366 | -0.74206 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.24 | 5.64 | 10.06 | 0.623364 | 0.36614 | 0.163455 | 0.04945 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.24 | 5.64 | 10.06 | 0.623364 | 1.00971 | 0.450763 | 0.61399 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.32413 | 1.037558 | 1.76699 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.69552 | 1.203357 | 2.09277 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.04746 | 1.360473 | 2.40152 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.3739 | 1.506205 | 2.68783 | null |
AlAs | Al | As | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.7075 | 1.655134 | 2.9804 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 2.24 | 5.64 | 10.06 | 0.623364 | -1.31169 | -0.585576 | -1.42233 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.9317 | -0.415938 | -1.089 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.53513 | -0.238897 | -0.74114 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.24 | 5.64 | 10.06 | 0.623364 | -0.06738 | -0.03008 | -0.33083 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.24 | 5.64 | 10.06 | 0.623364 | 0.35528 | 0.158607 | 0.03993 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.2865 | 1.020759 | 1.73398 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.61263 | 1.166353 | 2.02006 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 2.24 | 5.64 | 10.06 | 0.623364 | 2.96607 | 1.324138 | 2.33009 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.33454 | 1.488634 | 2.65327 | null |
AlAs | Al | As | Bi | As | 5 | M_As | 1 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 2.24 | 5.64 | 10.06 | 0.623364 | 3.7295 | 1.664955 | 2.99984 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 1.7 | 6.12 | 12.04 | 0.413757 | -1.53292 | -0.901718 | -1.49933 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 1.7 | 6.12 | 12.04 | 0.413757 | -1.25606 | -0.738859 | -1.25647 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.93525 | -0.550147 | -0.97506 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.4731 | -0.278294 | -0.56967 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.08029 | -0.047229 | -0.22509 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 1.7 | 6.12 | 12.04 | 0.413757 | 0.28686 | 0.168741 | 0.09697 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 1.7 | 6.12 | 12.04 | 0.413757 | 0.66211 | 0.389476 | 0.42613 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 1.7 | 6.12 | 12.04 | 0.413757 | 1.96423 | 1.155429 | 1.56835 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.2631 | 1.331235 | 1.83051 | null |
AlSb | Al | Sb | Al | Sb | 5 | M_Sb | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.48952 | 1.464424 | 2.02912 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 1.7 | 6.12 | 12.04 | 0.413757 | -1.46689 | -0.862876 | -1.44141 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.92475 | -0.543971 | -0.96585 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.56081 | -0.329888 | -0.6466 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 1.7 | 6.12 | 12.04 | 0.413757 | 0.0782 | 0.046 | -0.08607 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 1.7 | 6.12 | 12.04 | 0.413757 | 0.58358 | 0.343282 | 0.35725 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 1.7 | 6.12 | 12.04 | 0.413757 | 1.55476 | 0.914565 | 1.20916 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 1.7 | 6.12 | 12.04 | 0.413757 | 1.85895 | 1.0935 | 1.47599 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.12658 | 1.250929 | 1.71076 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.40005 | 1.411794 | 1.95065 | null |
AlSb | Al | Sb | Sb | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.6658 | 1.568118 | 2.18378 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 5 | 4 | 1.7 | 6.12 | 12.04 | 0.413757 | -1.43192 | -0.842306 | -1.41074 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 4 | 3 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.86463 | -0.508606 | -0.91311 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 3 | 2 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.51256 | -0.301506 | -0.60428 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 1.7 | 6.12 | 12.04 | 0.413757 | -0.13166 | -0.077447 | -0.27015 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 1.7 | 6.12 | 12.04 | 0.413757 | 0.39407 | 0.231806 | 0.19101 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 1.7 | 6.12 | 12.04 | 0.413757 | 1.58777 | 0.933982 | 1.23812 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 1.7 | 6.12 | 12.04 | 0.413757 | 1.892 | 1.112941 | 1.50498 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -2 | -3 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.16891 | 1.275829 | 1.74789 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -3 | -4 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.43087 | 1.429924 | 1.97768 | null |
AlSb | Al | Sb | Bi | Al | 3 | M_Al | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -4 | -5 | 1.7 | 6.12 | 12.04 | 0.413757 | 2.7358 | 1.609294 | 2.24518 | null |
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