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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CdS | Cd | S | V | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.3645 | 0.177805 | 0 | -0.534395 |
CdS | Cd | S | In | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | -0.1827 | -0.089122 | -0.48 | -0.44835 |
CdS | Cd | S | Li | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | -0.1143 | -0.055756 | -0.42 | -0.408468 |
CdS | Cd | S | Se | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | -0.1143 | -0.055756 | -0.42 | -0.389862 |
CdS | Cd | S | Br | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | -0.0687 | -0.033512 | -0.38 | -0.387122 |
CdS | Cd | S | I | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | -0.0345 | -0.016829 | -0.35 | -0.370442 |
CdS | Cd | S | Cs | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.1137 | 0.055463 | -0.22 | -0.337693 |
CdS | Cd | S | S | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.0567 | 0.027659 | -0.27 | -0.304977 |
CdS | Cd | S | Rb | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.0453 | 0.022098 | -0.28 | -0.29065 |
CdS | Cd | S | Se | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.2277 | 0.111073 | -0.12 | -0.118338 |
CdS | Cd | S | S | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.3075 | 0.15 | -0.05 | 0.038642 |
CdS | Cd | S | O | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.0225 | 0.010976 | -0.3 | 0.384846 |
CdS | Cd | S | O | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.4785 | 0.233415 | 0.1 | 0.384846 |
CdS | Cd | S | Te | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.9687 | 0.472537 | 0.53 | 0.720983 |
CdS | Cd | S | Pt | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.6267 | 0.305707 | 0.23 | 0.781622 |
CdS | Cd | S | Pt | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.1853 | 0.578195 | 0.72 | 1.046635 |
CdS | Cd | S | As | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.1169 | 0.544829 | 0.66 | 1.140508 |
CdS | Cd | S | S | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.8889 | 0.43361 | 0.46 | 1.195369 |
CdS | Cd | S | S | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.3107 | 0.639366 | 0.83 | 1.203939 |
CdS | Cd | S | S | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.0029 | 0.48922 | 0.56 | 1.230644 |
CdS | Cd | S | S | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.5273 | 0.745024 | 1.02 | 1.230644 |
CdS | Cd | S | Al | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.1625 | 0.567073 | 0.7 | 1.260273 |
CdS | Cd | S | Ga | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.0599 | 0.517024 | 0.61 | 1.264583 |
CdS | Cd | S | S | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.8693 | 0.911854 | 1.32 | 1.321341 |
CdS | Cd | S | Se | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.0941 | 0.533707 | 0.64 | 1.352689 |
CdS | Cd | S | Rh | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.9801 | 0.478098 | 0.54 | 1.493676 |
CdS | Cd | S | S | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.3107 | 0.639366 | 0.83 | 1.510112 |
CdS | Cd | S | S | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.3107 | 0.639366 | 0.83 | 1.54015 |
CdS | Cd | S | S | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.0517 | 1.000829 | 1.48 | 1.54015 |
CdS | Cd | S | S | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.2537 | 0.611561 | 0.78 | 1.557788 |
CdS | Cd | S | S | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.6527 | 0.806195 | 1.13 | 1.557788 |
CdS | Cd | S | Se | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.5501 | 0.756146 | 1.04 | 1.584175 |
CdS | Cd | S | O | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 0.9003 | 0.439171 | 0.47 | 1.625891 |
CdS | Cd | S | O | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.7699 | 1.351171 | 2.11 | 1.625891 |
CdS | Cd | S | S | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.0745 | 1.011951 | 1.5 | 1.676017 |
CdS | Cd | S | S | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.1771 | 1.062 | 1.59 | 1.770602 |
CdS | Cd | S | Ir | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.2537 | 0.611561 | 0.78 | 1.785156 |
CdS | Cd | S | Be | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.6527 | 0.806195 | 1.13 | 1.816603 |
CdS | Cd | S | Na | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.7211 | 0.839561 | 1.19 | 1.820558 |
CdS | Cd | S | Rh | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.6527 | 0.806195 | 1.13 | 1.912431 |
CdS | Cd | S | Cd | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.7097 | 0.834 | 1.18 | 1.97006 |
CdS | Cd | S | Cd | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.6983 | 0.828439 | 1.17 | 1.974 |
CdS | Cd | S | Te | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.7895 | 0.872927 | 1.25 | 1.977514 |
CdS | Cd | S | Ir | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.8237 | 0.88961 | 1.28 | 2.056515 |
CdS | Cd | S | Te | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.2455 | 1.095366 | 1.65 | 2.116971 |
CdS | Cd | S | Be | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.0289 | 0.989707 | 1.46 | 2.150321 |
CdS | Cd | S | Zn | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.8693 | 0.911854 | 1.32 | 2.170509 |
CdS | Cd | S | S | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.5875 | 1.262195 | 1.95 | 2.175844 |
CdS | Cd | S | Zn | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.1771 | 1.062 | 1.59 | 2.181712 |
CdS | Cd | S | Cd | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.9263 | 0.939659 | 1.37 | 2.213731 |
CdS | Cd | S | Ta | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.9491 | 0.95078 | 1.39 | 2.221635 |
CdS | Cd | S | Cd | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.8693 | 0.911854 | 1.32 | 2.225421 |
CdS | Cd | S | Zr | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.7781 | 0.867366 | 1.24 | 2.225537 |
CdS | Cd | S | Ti | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.0289 | 0.989707 | 1.46 | 2.229102 |
CdS | Cd | S | Mo | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.9605 | 0.956341 | 1.4 | 2.249826 |
CdS | Cd | S | Zn | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.4621 | 1.201024 | 1.84 | 2.2922 |
CdS | Cd | S | Se | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.1087 | 1.028634 | 1.53 | 2.29459 |
CdS | Cd | S | Se | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.0549 | 1.490195 | 2.36 | 2.29459 |
CdS | Cd | S | V | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 1.8807 | 0.917415 | 1.33 | 2.302878 |
CdS | Cd | S | Te | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.7813 | 1.356732 | 2.12 | 2.364294 |
CdS | Cd | S | Sn | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 2 | 1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.1315 | 1.039756 | 1.55 | 2.37013 |
CdS | Cd | S | Ir | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3937 | 1.167659 | 1.78 | 2.429396 |
CdS | Cd | S | Rh | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3595 | 1.150976 | 1.75 | 2.430418 |
CdS | Cd | S | In | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.1087 | 1.028634 | 1.53 | 2.438166 |
CdS | Cd | S | Cd | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3481 | 1.145415 | 1.74 | 2.497765 |
CdS | Cd | S | Cd | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.7813 | 1.356732 | 2.12 | 2.497765 |
CdS | Cd | S | Li | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.2227 | 1.084244 | 1.63 | 2.507854 |
CdS | Cd | S | Zr | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3937 | 1.167659 | 1.78 | 2.524167 |
CdS | Cd | S | Br | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.2797 | 1.112049 | 1.68 | 2.540562 |
CdS | Cd | S | Cs | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.4279 | 1.184341 | 1.81 | 2.558652 |
CdS | Cd | S | As | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3253 | 1.134293 | 1.72 | 2.574987 |
CdS | Cd | S | I | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3481 | 1.145415 | 1.74 | 2.586323 |
CdS | Cd | S | Mo | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.4735 | 1.206585 | 1.85 | 2.626791 |
CdS | Cd | S | Rb | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.4051 | 1.17322 | 1.79 | 2.63368 |
CdS | Cd | S | Ga | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.4393 | 1.189902 | 1.82 | 2.652534 |
CdS | Cd | S | Cd | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.1657 | 1.056439 | 1.58 | 2.714629 |
CdS | Cd | S | Cd | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.1461 | 1.534683 | 2.44 | 2.714629 |
CdS | Cd | S | Al | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.5647 | 1.251073 | 1.93 | 2.740157 |
CdS | Cd | S | Na | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.5647 | 1.251073 | 1.93 | 2.744304 |
CdS | Cd | S | Cd | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.2797 | 1.112049 | 1.68 | 2.755 |
CdS | Cd | S | Cd | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.1119 | 1.518 | 2.41 | 2.755 |
CdS | Cd | S | Pt | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.6217 | 1.278878 | 1.98 | 2.793851 |
CdS | Cd | S | Se | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.5875 | 1.262195 | 1.95 | 2.806917 |
CdS | Cd | S | Ta | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.5533 | 1.245512 | 1.92 | 2.84935 |
CdS | Cd | S | As | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.8953 | 1.412341 | 2.22 | 2.852774 |
CdS | Cd | S | Cd | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.3937 | 1.167659 | 1.78 | 2.879927 |
CdS | Cd | S | Cd | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.1005 | 1.512439 | 2.4 | 2.879927 |
CdS | Cd | S | As | 0 | int_neut | M_i_neut_site | 0 | 1 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.2373 | 1.579171 | 2.52 | 2.881803 |
CdS | Cd | S | V | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.6217 | 1.278878 | 1.98 | 2.888623 |
CdS | Cd | S | Sn | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.7129 | 1.323366 | 2.06 | 2.912161 |
CdS | Cd | S | Ti | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 1 | 0 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.5647 | 1.251073 | 1.93 | 2.938285 |
CdS | Cd | S | Ir | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.9751 | 1.451268 | 2.29 | 2.953393 |
CdS | Cd | S | Mo | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.9523 | 1.440146 | 2.27 | 3.019493 |
CdS | Cd | S | Rh | 0 | int_5 | M_i_S_site | 0 | 1 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.0207 | 1.473512 | 2.33 | 3.022 |
CdS | Cd | S | Be | 0 | int_3 | M_i_Cd_site | 0 | 1 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.9523 | 1.440146 | 2.27 | 3.042817 |
CdS | Cd | S | In | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.7813 | 1.356732 | 2.12 | 3.050825 |
CdS | Cd | S | Zr | Cd | 3 | M_Cd | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.9067 | 1.417902 | 2.23 | 3.065242 |
CdS | Cd | S | Zn | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.9409 | 1.434585 | 2.26 | 3.087423 |
CdS | Cd | S | Cd | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | -2 | 2.05 | 5.94 | 8.9 | 0.6515 | 3.1347 | 1.529122 | 2.43 | 3.0901 |
CdS | Cd | S | Na | S | 5 | M_S | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | 0 | -1 | 2.05 | 5.94 | 8.9 | 0.6515 | 2.9409 | 1.434585 | 2.26 | 3.143842 |
Subsets and Splits
No community queries yet
The top public SQL queries from the community will appear here once available.