mp_ID stringlengths 4 10 | x float64 -10.28 17.7 | y float64 -12.01 23.9 | z float64 -8.99 7.96 | type stringclasses 2
values | formula stringlengths 2 26 | n_atoms int64 1 444 | spacegroup int64 1 230 | volume float64 5.61 20.1k |
|---|---|---|---|---|---|---|---|---|
mp-1200168 | -1.116374 | 0.597992 | 2.33622 | other | Si29C29 | 58 | 160 | 608.57 |
mp-1202023 | -4.842653 | -1.787041 | -6.729453 | other | Zn18S18 | 36 | 160 | 732.34 |
mp-1227077 | -7.771713 | -6.437352 | 2.335894 | other | Cd43Pd8 | 51 | 160 | 1,015.12 |
mp-18377 | -4.843249 | -1.785451 | -6.730136 | other | Zn10S10 | 20 | 160 | 405.95 |
mp-1172873 | -5.655258 | -3.393123 | -1.969403 | other | Ge1Te1 | 2 | 160 | 66.3 |
mp-13870 | -4.669063 | -0.929793 | -2.924152 | other | Ta2Se4 | 6 | 160 | 139.77 |
mp-7597 | -4.567578 | -0.86195 | -3.073857 | other | Nb1Se2 | 3 | 160 | 71.16 |
mp-1222780 | -6.756929 | -6.733104 | 6.943367 | other | La3Y3 | 6 | 160 | 214.5 |
mp-1228630 | -3.342912 | 1.846624 | 2.774217 | other | B13P1 | 14 | 160 | 116.2 |
mp-1412582 | 12.013595 | 13.388515 | -2.468975 | other | V4O8 | 12 | 160 | 144.73 |
mp-1388847 | 9.260908 | 12.757031 | -2.329899 | other | Cr4O8 | 12 | 160 | 140.85 |
mp-1407373 | 5.999747 | 11.469678 | -1.617982 | other | Ni4O8 | 12 | 160 | 131.41 |
mp-1217172 | -3.942121 | -0.163316 | -4.227388 | other | Ti5S8 | 13 | 160 | 241.12 |
mp-15651 | -5.525437 | -1.648287 | -3.198924 | other | Ni3Se3 | 6 | 160 | 94.69 |
mp-685056 | -4.496732 | -1.351415 | -5.021643 | other | Cu9S16 | 25 | 160 | 525.64 |
mp-1200568 | -4.845161 | -1.791466 | -6.733369 | other | Zn18S18 | 36 | 160 | 735.75 |
mp-1228640 | -3.13876 | 1.706725 | 2.713541 | other | B12S1 | 13 | 160 | 111.38 |
mp-938 | -5.604451 | -3.376436 | -1.979036 | other | Ge1Te1 | 2 | 160 | 55.91 |
mp-579102 | 11.872829 | 8.753507 | 1.783896 | other | Sm32O21 | 53 | 160 | 1,303.47 |
mp-1220109 | -5.383863 | -1.05157 | -4.247086 | other | Ni3S2 | 5 | 160 | 68.92 |
mp-1219457 | -5.092985 | -4.70195 | 0.102678 | other | Sb1As1 | 2 | 160 | 53.2 |
mp-1227357 | -5.148961 | -1.482297 | 4.452653 | other | Be9Cu3 | 12 | 160 | 103.8 |
mp-1219373 | -5.660306 | -3.850645 | -1.319268 | other | Sc3Te4 | 7 | 160 | 209.76 |
mp-33046 | 0.557177 | 1.39415 | 2.775498 | other | Ti22N22 | 44 | 160 | 480.65 |
mp-685189 | -5.514704 | -2.923941 | -4.375678 | other | Cu29Se19 | 48 | 160 | 884.18 |
mp-23162 | 0.887714 | 1.283018 | -3.163441 | other | Zr1Cl2 | 3 | 160 | 66.85 |
mp-555410 | -4.84276 | -1.744709 | -6.707887 | other | Zn4S4 | 8 | 160 | 156.44 |
mp-627401 | -1.19179 | 2.833306 | -3.003312 | other | Cd5I10 | 15 | 160 | 598.42 |
mp-1199063 | -1.113888 | 0.598736 | 2.335358 | other | Si28C28 | 56 | 160 | 587.87 |
mp-1194040 | -6.827315 | -1.481745 | 5.57779 | other | Mn10Al16 | 26 | 160 | 352.5 |
mp-570690 | -1.108078 | 0.596594 | 2.333895 | other | Si9C9 | 18 | 160 | 189.07 |
mp-555763 | -4.843601 | -1.745161 | -6.709891 | other | Zn3S3 | 6 | 160 | 117.33 |
mp-624397 | -1.114572 | 0.597858 | 2.335692 | other | Si11C11 | 22 | 160 | 230.89 |
mp-556468 | -4.84105 | -1.782241 | -6.726607 | other | Zn8S8 | 16 | 160 | 323.75 |
mp-756488 | 6.125958 | 13.112019 | -2.533859 | other | Co4O8 | 12 | 160 | 129.94 |
mp-1224391 | 0.825974 | 1.257695 | 2.767143 | other | Hf4N3 | 7 | 160 | 91.95 |
mp-628808 | -9.158271 | -5.408552 | 3.379555 | other | Cu14Hg12 | 26 | 160 | 712.05 |
mp-1407587 | 8.007063 | 13.863679 | -1.770687 | other | Mn4O8 | 12 | 160 | 145.78 |
mp-1217883 | -5.623685 | -2.558745 | 4.908142 | other | Ta39Al69 | 108 | 160 | 1,773.89 |
mp-966 | -4.078799 | -0.034563 | -3.77967 | other | Nb1S2 | 3 | 160 | 62.51 |
mp-1225769 | -8.793218 | -4.594285 | 3.264627 | other | Cu5Ge2 | 7 | 160 | 96.49 |
mp-1222752 | -6.748006 | -6.711653 | 6.938772 | other | La3Y3 | 6 | 160 | 211.14 |
mp-10014 | -4.145227 | -0.03055 | -3.643365 | other | Ta1S2 | 3 | 160 | 61.05 |
mp-1216474 | -4.80609 | -0.007365 | 2.93811 | other | V4C3 | 7 | 160 | 69.49 |
mp-1216163 | -7.631913 | -10.051597 | 6.597694 | other | Y4Mg25 | 29 | 160 | 709 |
mp-1227576 | -9.216981 | -4.690328 | 3.380209 | other | Cu81Sn22 | 103 | 160 | 1,469.49 |
mp-1040834 | 12.932736 | 10.587751 | -0.202068 | other | W4O8 | 12 | 160 | 179.45 |
mp-10188 | -5.477011 | -0.656531 | -4.176303 | other | Fe3S4 | 7 | 160 | 103.54 |
mp-1200692 | -1.15589 | 0.558847 | 2.360722 | other | Si17C17 | 34 | 160 | 350.68 |
mp-1220501 | -3.724458 | -0.450144 | 2.78318 | other | Nb4C3 | 7 | 160 | 88.75 |
mp-608468 | -4.845606 | -1.792589 | -6.734054 | other | Zn12S12 | 24 | 160 | 491.13 |
mp-1202182 | -4.84398 | -1.790252 | -6.731465 | other | Zn18S18 | 36 | 160 | 734.92 |
mp-1225654 | 0.942923 | 2.00209 | -5.325252 | other | Cu1Cl1 | 2 | 160 | 39.07 |
mp-11342 | -4.806801 | -2.684696 | -4.032972 | other | Ga2Se2 | 4 | 160 | 107.38 |
mp-1204356 | -1.155947 | 0.561257 | 2.360266 | other | Si19C19 | 38 | 160 | 391.94 |
mp-27658 | -3.582211 | 0.870989 | 3.179382 | other | Li5B4 | 9 | 160 | 108.62 |
mp-16226 | -4.069945 | -0.043435 | -3.66108 | other | Ta2S4 | 6 | 160 | 121.88 |
mp-1180507 | -3.255577 | 1.647978 | 2.867617 | other | Li1B11 | 12 | 160 | 87.45 |
mp-1181998 | 7.016416 | 5.709661 | -2.951697 | other | Br1O1 | 2 | 160 | 39.07 |
mp-1192989 | -9.221136 | -5.401925 | 3.260091 | other | Cu14Hg12 | 26 | 160 | 433.57 |
mp-581258 | -4.842659 | -1.785004 | -6.729181 | other | Zn12S12 | 24 | 160 | 486.97 |
mp-1221436 | 2.154092 | 2.950128 | -4.43989 | other | Mo1Cl6 | 7 | 162 | 187.01 |
mp-248 | -6.874744 | 0.541451 | 3.609138 | other | Fe6N3 | 9 | 162 | 84.5 |
mp-557194 | 13.837996 | 6.2516 | -0.588045 | other | Si6O12 | 18 | 162 | 287.24 |
mp-33090 | -0.215031 | 1.930262 | 2.406831 | other | V6N3 | 9 | 162 | 93.63 |
mp-27819 | 8.734731 | 8.543397 | -1.33681 | other | Ag6O2 | 8 | 162 | 122.24 |
mp-1080866 | -4.289285 | -4.912052 | -3.402776 | other | Ce12Se24 | 36 | 162 | 2,339.39 |
mp-569157 | -1.028339 | 2.235754 | -3.036023 | original | Bi2I6 | 8 | 162 | 368.32 |
mp-1079438 | 0.855035 | 1.605119 | 2.713182 | other | Ta6N3 | 9 | 162 | 120 |
mp-556963 | 14.956613 | 5.95657 | -0.052637 | other | Si12O24 | 36 | 162 | 530.92 |
mp-27908 | -6.884227 | 0.637087 | 3.721328 | other | Fe24N10 | 34 | 162 | 330.45 |
mp-1080316 | -4.22533 | -4.877517 | -3.399063 | other | Ce6Se12 | 18 | 162 | 1,033.8 |
mp-1182868 | 6.461887 | 8.689209 | -2.603306 | other | Al2O6 | 8 | 162 | 102.37 |
mp-567354 | 1.465228 | 2.343197 | -4.629058 | other | Ti2Cl6 | 8 | 162 | 207.22 |
mp-1215783 | -5.903336 | -3.903992 | 3.441432 | other | Zr10Sn7 | 17 | 162 | 389.95 |
mp-8780 | 0.041161 | 2.139965 | 2.351901 | other | Cr6N3 | 9 | 162 | 85.55 |
mp-548170 | 11.299191 | 9.064733 | 1.825313 | other | U3O8 | 11 | 162 | 151.42 |
mp-569391 | 1.149439 | 1.80533 | -4.258953 | other | Zr2Cl6 | 8 | 162 | 224.57 |
mp-1079585 | 0.533996 | 1.303147 | 2.814003 | other | Nb6N3 | 9 | 162 | 123.53 |
mp-567397 | -5.149837 | -0.165939 | 3.188377 | other | W6C3 | 9 | 162 | 114.38 |
mp-1220831 | -5.679708 | -2.355882 | 3.442971 | other | Nb10Ge7 | 17 | 162 | 289.3 |
mp-569339 | -8.845819 | -4.820713 | 3.186309 | other | Cu20Sn6 | 26 | 162 | 396.91 |
mp-569005 | 1.989306 | 2.944998 | -4.430493 | other | Mo6Cl24 | 30 | 162 | 812.07 |
mp-1221517 | 1.986816 | 2.916065 | -4.397028 | other | Mo3Cl12 | 15 | 162 | 352.14 |
mp-882 | 12.187782 | 9.079509 | 2.553082 | other | Ti12O2 | 14 | 162 | 213.51 |
mp-13685 | -5.5768 | -0.063079 | -5.547989 | other | Cr8S12 | 20 | 163 | 354.25 |
mp-2591 | 12.23032 | 9.213367 | 2.516198 | other | Ti12O4 | 16 | 163 | 216.74 |
mp-556464 | 14.537112 | 6.00555 | -0.214216 | other | Si12O24 | 36 | 163 | 449.04 |
mp-1189023 | -5.422617 | -1.622941 | -3.810538 | other | Cr8Se12 | 20 | 163 | 409.37 |
mp-1094153 | -4.196371 | -4.736648 | -3.443932 | other | Ce12Se24 | 36 | 163 | 2,268.92 |
mp-684640 | 1.89827 | 2.914294 | -4.540608 | other | Mo8Cl24 | 32 | 163 | 889.49 |
mp-554098 | 12.192215 | 9.079485 | 2.534627 | other | Ti12O2 | 14 | 163 | 213.42 |
mp-1080373 | -4.295415 | -4.899839 | -3.398648 | other | Ce12Se24 | 36 | 163 | 1,908.72 |
mp-776655 | 12.882421 | 10.782186 | 1.857761 | other | Ti8O12 | 20 | 163 | 217.76 |
mp-760992 | 10.311189 | 12.482972 | -4.130105 | other | V18O42 | 60 | 163 | 959.34 |
mp-567330 | 1.46811 | 2.342613 | -4.615672 | other | Ti4Cl12 | 16 | 163 | 406.2 |
mp-1311 | -5.66043 | -0.46568 | -5.297251 | other | Cr10S12 | 22 | 163 | 350.77 |
mp-1208273 | -4.802463 | -1.456751 | -3.046059 | other | Ti8Se12 | 20 | 163 | 410.38 |
mp-755175 | 12.579401 | 7.56077 | 0.516309 | other | Al8O12 | 20 | 163 | 178.4 |
mp-2750 | -6.460615 | -2.66151 | -1.76056 | other | Cr8Te12 | 20 | 163 | 514.87 |
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