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-1081 | -4.808356 | 0.271225 | -4.407272 | other | V3S4 | 7 | 12 | 109.41 |
mp-1183089 | -6.585094 | -7.808834 | 5.430396 | other | Ac4Mg2 | 6 | 12 | 234.24 |
mp-1246684 | -5.45444 | -4.082207 | 0.571729 | other | Cu5As5 | 10 | 12 | 160.63 |
mp-1342828 | 9.231456 | 13.113533 | -1.072157 | other | Fe9O13 | 22 | 12 | 260.12 |
mp-1045898 | 13.179437 | 12.146937 | -0.588402 | other | V9O13 | 22 | 12 | 266.05 |
mp-1198191 | -4.828691 | -2.444692 | 2.538703 | other | Ti45Se16 | 61 | 12 | 1,016.21 |
mp-1221957 | -6.641398 | -7.501099 | 3.273129 | other | Mg1In1 | 2 | 12 | 48 |
mp-1045643 | 12.846867 | 10.556856 | 1.99933 | other | Ti9O13 | 22 | 12 | 251.49 |
mp-567207 | -6.551828 | -6.745592 | 3.163438 | other | Sr2In8 | 10 | 12 | 286.46 |
mp-1073070 | -2.281924 | -5.610604 | 7.288393 | other | Mg4Si6 | 10 | 12 | 178.22 |
mp-510554 | 11.3278 | 11.715261 | 2.664545 | other | Nb12O29 | 41 | 12 | 602.31 |
mp-1186252 | -7.473 | -6.84235 | 6.940037 | other | Nd4Mg2 | 6 | 12 | 190.32 |
mp-1201852 | 10.98876 | 11.946697 | 2.743795 | other | Nb16O40 | 56 | 12 | 813.42 |
mp-1185838 | -7.800542 | -10.0778 | 4.983957 | other | Mg5Pt1 | 6 | 12 | 121.11 |
mp-1120821 | -6.485778 | -5.082221 | 0.674455 | other | V8Bi6 | 14 | 12 | 292.76 |
mp-11800 | -5.582376 | -1.455715 | -2.991127 | original | Co3Se4 | 7 | 12 | 117.19 |
mp-1079094 | -5.539294 | -3.52255 | -1.785143 | other | Sb4Te6 | 10 | 12 | 276.55 |
mp-1078443 | -4.357474 | -2.414013 | -3.455694 | other | As4Se6 | 10 | 12 | 254.88 |
mp-973455 | -7.003924 | -11.02954 | 5.510242 | other | Li2Mg4 | 6 | 12 | 124.19 |
mp-28879 | -3.640527 | -4.360852 | 0.627854 | other | Ca5P8 | 13 | 12 | 293.09 |
mp-684934 | 11.418297 | 8.521895 | 2.08245 | other | U5O11 | 16 | 12 | 198.92 |
mp-1038896 | -6.291425 | -5.741385 | 0.531867 | other | Mg2Bi4 | 6 | 12 | 178.99 |
mp-1094646 | -6.299177 | -6.010531 | 3.637325 | other | Mg2Ga4 | 6 | 12 | 116.73 |
mp-18280 | 15.660065 | 5.645941 | 0.395822 | other | Si12O24 | 36 | 12 | 700.45 |
mp-1185840 | -8.074256 | -6.814411 | 2.314749 | other | Mg2Ag4 | 6 | 12 | 110.09 |
mp-1080203 | 2.155461 | 2.5264 | -0.189204 | other | Cu2N2 | 4 | 12 | 44.11 |
mp-1180648 | -3.748558 | -1.720842 | -4.060605 | other | K1S1 | 2 | 12 | 394.3 |
mp-29465 | 1.605564 | 2.516351 | -4.271941 | other | Ta2Cl8 | 10 | 12 | 261.13 |
mp-1185936 | -6.302185 | -7.005733 | 2.366278 | other | Mg2Pb4 | 6 | 12 | 167.66 |
mp-1186819 | -3.948547 | -7.053859 | 1.912812 | other | Rb4Mg2 | 6 | 12 | 375.27 |
mp-6950 | -5.529033 | -5.626903 | 0.555941 | other | Ba2Sb6 | 8 | 12 | 288.09 |
mp-31019 | -6.554726 | -2.52154 | 6.42221 | other | Al45Cr7 | 52 | 12 | 790.73 |
mp-1180260 | 6.441286 | 8.756098 | -2.473138 | other | Mg1O2 | 3 | 12 | 33.76 |
mp-1078012 | -6.493615 | -2.664226 | -1.721386 | other | Cr3Te4 | 7 | 12 | 175.77 |
mp-1272680 | 6.075704 | 13.30755 | -2.588627 | other | Co4O8 | 12 | 12 | 135.11 |
mp-11697 | -5.828662 | -3.312351 | 1.757913 | other | Ta2Sb4 | 6 | 12 | 136.77 |
mp-22510 | -6.729979 | -0.538142 | 3.704992 | other | Fe4Ge4 | 8 | 12 | 109.64 |
mp-1077372 | -6.065717 | -3.795216 | 4.003854 | other | Zr4Cu2 | 6 | 12 | 116.83 |
mp-567624 | -0.46279 | 1.397934 | -4.453295 | other | Cr1Br2 | 3 | 12 | 88.67 |
mp-15325 | -4.833311 | -4.845846 | 0.313579 | other | Ba2As6 | 8 | 12 | 226.1 |
mp-1073227 | -2.662269 | -5.409534 | 7.156835 | other | Mg4Si6 | 10 | 12 | 171.88 |
mp-676620 | -4.943095 | -5.174917 | 0.436748 | other | Li27As10 | 37 | 12 | 568.05 |
mp-30464 | -7.29324 | -4.388962 | 0.675831 | other | Bi4Pd10 | 14 | 12 | 253.69 |
mp-1219748 | 1.763204 | 2.674375 | -4.712781 | other | Pt2Cl4 | 6 | 12 | 151.76 |
mp-1078331 | -5.589808 | -3.574705 | -2.034072 | other | Sb4Te6 | 10 | 12 | 351.7 |
mp-1073777 | -2.331574 | -6.737514 | 7.646776 | other | Mg6Si6 | 12 | 12 | 226.28 |
mp-1094837 | -6.505198 | -5.97976 | 5.541277 | other | Ce4Mg2 | 6 | 12 | 157.98 |
mp-1220932 | -4.042561 | -4.88391 | 5.659711 | other | Na10Si102 | 112 | 12 | 2,405.02 |
mp-863316 | 6.956089 | 7.742604 | -3.489521 | other | Fe2O6 | 8 | 12 | 122.94 |
mp-1218065 | -5.528666 | -2.133387 | 3.219663 | other | Ta12O2 | 14 | 12 | 231.79 |
mp-1199998 | 15.516796 | 5.696475 | 0.310191 | other | Si38O76 | 114 | 12 | 2,504.26 |
mp-1213182 | -6.948507 | 0.295127 | 3.646097 | other | Fe26Mo18 | 44 | 12 | 553.19 |
mp-754698 | 12.751538 | 10.800122 | 2.186958 | other | Nb4O8 | 12 | 12 | 166.69 |
mp-680850 | -4.918005 | -2.514369 | 2.634139 | other | Ti32S12 | 44 | 12 | 672.4 |
mp-23219 | -0.457906 | 1.343751 | -4.291378 | other | Cu1Br2 | 3 | 12 | 80.29 |
mp-685047 | -5.267736 | -1.330363 | -3.281329 | other | V23Se40 | 63 | 12 | 1,267.65 |
mp-1039397 | -5.193437 | -7.358638 | 3.96237 | other | Ca4Mg2 | 6 | 12 | 212.45 |
mp-570219 | -0.596614 | 1.12998 | -4.131738 | other | In2Br6 | 8 | 12 | 263.12 |
mp-27215 | -1.054129 | 2.654963 | -2.993604 | other | Cr1I2 | 3 | 12 | 113.61 |
mp-1073578 | -3.10513 | -5.187531 | 6.689715 | other | Mg2Si4 | 6 | 12 | 99.44 |
mp-541637 | -0.961673 | 0.972625 | -1.613188 | other | Er4I5 | 9 | 12 | 309.65 |
mp-1073635 | -3.037732 | -5.189785 | 6.799088 | other | Mg4Si8 | 12 | 12 | 207.39 |
mp-1178232 | 12.628696 | 11.355994 | 0.133211 | other | Fe4O4 | 8 | 12 | 85.18 |
mp-1094553 | -6.74916 | -9.715816 | 2.971199 | other | Mg4Sb2 | 6 | 12 | 147.55 |
mp-1094206 | -6.330354 | -6.42367 | 2.087294 | other | Mg2Sn4 | 6 | 12 | 155.34 |
mp-1182783 | -5.817956 | -3.751099 | -1.886052 | other | Bi2Te3 | 5 | 12 | 358.7 |
mp-1094132 | -8.197896 | -6.230679 | 6.223247 | other | Lu10Ga6 | 16 | 12 | 378.67 |
mp-22700 | -5.374409 | -1.301167 | -3.196511 | other | V3Se4 | 7 | 12 | 127.52 |
mp-31467 | -8.187739 | -4.254306 | 1.941135 | other | Ga3Pd7 | 10 | 12 | 147.02 |
mp-11687 | -6.115911 | -2.110552 | -1.646044 | other | V3Te6 | 9 | 12 | 243.09 |
mp-1205422 | -8.192644 | -0.666693 | 4.282987 | other | Hf4Co14 | 18 | 12 | 231.19 |
mp-1094543 | -6.913889 | -10.44658 | 4.208608 | other | Mg4Sn2 | 6 | 12 | 142.57 |
mp-1182583 | -4.329834 | -2.800083 | -3.737573 | other | Bi2Se3 | 5 | 12 | 216.5 |
mp-667383 | 15.594411 | 5.653202 | 0.350761 | other | Si28O56 | 84 | 12 | 1,601.36 |
mp-1215799 | -4.493177 | -3.789278 | -3.680999 | other | Yb5Se7 | 12 | 12 | 331.15 |
mp-570562 | -6.210689 | -2.675508 | -1.081402 | other | Te6Pt4 | 10 | 12 | 250.89 |
mp-662706 | 15.547515 | 5.69514 | 0.367414 | other | Si28O56 | 84 | 12 | 1,512.28 |
mp-32679 | -3.719018 | -0.453884 | 2.757488 | other | Nb10C7 | 17 | 12 | 224.6 |
mp-1094531 | -7.311597 | -6.849731 | 6.678516 | other | Y4Mg2 | 6 | 12 | 176.73 |
mp-1080428 | -0.951023 | 0.964144 | -3.672495 | other | Nb2Br8 | 10 | 12 | 310.21 |
mp-1224025 | -6.813641 | -6.351329 | 2.280161 | other | In3Sn1 | 4 | 12 | 109.2 |
mp-684969 | -2.604717 | -2.698531 | -5.546031 | other | Sc4S6 | 10 | 12 | 213.59 |
mp-1073739 | -2.619509 | -6.729998 | 7.587624 | other | Mg2Si2 | 4 | 12 | 70.83 |
mp-9548 | -4.678253 | -4.618879 | 0.091418 | other | Ge6As6 | 12 | 12 | 296.32 |
mp-542454 | -5.78675 | -1.575788 | 2.11278 | other | Mo4As6 | 10 | 12 | 174.37 |
mp-715614 | 9.412398 | 13.089179 | -0.812178 | other | Fe6O8 | 14 | 12 | 151.79 |
mp-1100449 | -3.232266 | -7.731612 | 7.529025 | other | Mg3Si2 | 5 | 12 | 96.89 |
mp-1218446 | 1.583997 | 1.778334 | 1.282914 | other | Sr4N3 | 7 | 12 | 168.25 |
mp-1063020 | -5.591946 | -3.021575 | 3.75528 | other | Mg1Nb2 | 3 | 12 | 57.64 |
mp-31002 | -5.883124 | -3.342952 | -1.824463 | other | Rb2Te5 | 7 | 12 | 281.7 |
mp-1094511 | -5.064727 | -3.080647 | 4.147947 | other | Mg2Ti4 | 6 | 12 | 112.12 |
mp-2512 | -7.476774 | -3.942025 | 1.392763 | original | As2Pd10 | 12 | 12 | 181.96 |
mp-571256 | 2.049323 | 2.960657 | -4.401092 | other | Mo6Cl30 | 36 | 12 | 970.17 |
mp-27194 | -1.259614 | 2.563222 | -3.009876 | other | Sn3I6 | 9 | 12 | 362.59 |
mp-1066655 | -3.886909 | -6.972883 | 1.812405 | other | K3Rh1 | 4 | 12 | 177.25 |
mp-1039091 | -6.409436 | -7.121925 | 1.18248 | other | Mg4Bi2 | 6 | 12 | 156.47 |
mp-557691 | 9.593941 | 8.452631 | 2.97121 | other | La6O9 | 15 | 12 | 254.45 |
mp-1094491 | -6.086258 | -10.733207 | 5.681451 | other | Sr2Mg4 | 6 | 12 | 193.17 |
mp-1178827 | 9.382792 | 12.082957 | -4.322885 | other | V3O8 | 11 | 12 | 139.65 |
mp-1185854 | -8.542123 | -5.979594 | 2.024105 | other | Mg2Au4 | 6 | 12 | 108.86 |
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