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-12723 | -8.124981 | -6.400346 | 3.074564 | original | Ca2Au2 | 4 | 63 | 101.14 |
mp-6914 | -5.921344 | -7.03239 | 4.155561 | other | Ca2Ga2 | 4 | 63 | 104.22 |
mp-31509 | -5.554818 | -6.924605 | 3.357574 | other | Ba4In4 | 8 | 63 | 296.18 |
mp-1094502 | -7.094802 | -8.85377 | 6.582185 | other | Mg4Ti2 | 6 | 63 | 123.21 |
mp-972175 | -8.806484 | -5.945214 | 3.050515 | other | Zn6In2 | 8 | 63 | 148.86 |
mp-1038789 | -6.488183 | -7.254226 | 1.344161 | other | Mg4Bi2 | 6 | 63 | 158.14 |
mp-1079902 | 3.578208 | -0.492501 | -2.454263 | other | Sn2H8 | 10 | 63 | 130.77 |
mp-1189230 | -6.177365 | -7.4699 | 3.197607 | other | Ca6Tl10 | 16 | 63 | 458.15 |
mp-1039393 | -6.38211 | -10.397857 | 5.827916 | other | Ca2Mg4 | 6 | 63 | 168.58 |
mp-1007692 | -8.060214 | -4.584547 | 3.276445 | other | Hf2Pd2 | 4 | 63 | 73.46 |
mp-1046039 | 13.16805 | 11.919077 | -0.480516 | other | V10O14 | 24 | 63 | 292.37 |
mp-1039421 | -5.165421 | -7.347826 | 3.952799 | other | Ca4Mg2 | 6 | 63 | 214.5 |
mp-1009 | -4.067455 | -4.932139 | 5.742617 | other | Sr2Si12 | 14 | 63 | 271.53 |
mp-255 | -6.884613 | -7.588244 | 2.201508 | other | Na4Hg4 | 8 | 63 | 199.72 |
mp-1208530 | -9.209277 | -5.161039 | 2.864254 | other | Zn148Pd42 | 190 | 63 | 2,831.83 |
mp-1232339 | 5.671368 | 2.047244 | -2.784227 | other | Li2C24 | 26 | 63 | 226.46 |
mp-1198760 | -6.506444 | -6.489368 | 2.05979 | other | Na40Sn104 | 144 | 63 | 4,601.25 |
mp-1368296 | 9.393637 | 10.488116 | -2.73503 | other | Re4O14 | 18 | 63 | 260.22 |
mp-1086673 | -5.845375 | -3.454101 | -1.672186 | other | Dy2Te6 | 8 | 63 | 247.7 |
mp-11243 | -9.14229 | -6.428402 | 3.648615 | other | Er2Au2 | 4 | 63 | 91.47 |
mp-1103932 | -5.836605 | -3.543271 | -1.636956 | original | Dy4Te10 | 14 | 63 | 419.94 |
mp-1047762 | 5.748986 | 11.592036 | -1.639863 | other | Ni4O8 | 12 | 63 | 120.6 |
mp-1094572 | -6.793063 | -9.69185 | 3.033623 | other | Mg4Sb2 | 6 | 63 | 144.77 |
mp-569486 | -8.019381 | -6.786838 | 2.593437 | other | Yb4Ag14 | 18 | 63 | 374.39 |
mp-1187899 | -6.071494 | -7.372687 | 4.567392 | other | Yb4Mg2 | 6 | 63 | 205.18 |
mp-1065793 | -6.720823 | -4.297915 | 2.622833 | other | Pu2Pt2 | 4 | 63 | 86.6 |
mp-1189484 | -6.110821 | -5.813668 | 3.999584 | other | Eu6Ge10 | 16 | 63 | 376.29 |
mp-1043494 | 12.336087 | 10.681606 | -1.142493 | other | W4O10 | 14 | 63 | 272.68 |
mp-1077102 | -7.184088 | -5.7008 | 3.764307 | other | Tm2Sn4 | 6 | 63 | 152.6 |
mp-1387551 | -7.27151 | -6.868504 | 6.673245 | other | Y4Mg2 | 6 | 63 | 175.55 |
mp-999291 | -8.617755 | -5.984768 | 4.584782 | other | Pr2Pd2 | 4 | 63 | 99.44 |
mp-1094616 | -6.290735 | -6.027439 | 3.594682 | other | Mg2Ga4 | 6 | 63 | 115.1 |
mp-1094763 | -7.387553 | -7.104335 | 2.537184 | other | Mg4Cd8 | 12 | 63 | 252.58 |
mp-2620 | -4.995792 | -4.358571 | 6.144901 | other | Dy2Si2 | 4 | 63 | 85.93 |
mp-1104563 | -7.671367 | -3.132731 | 4.910968 | other | Mn2Ga12 | 14 | 63 | 222.22 |
mp-20253 | -5.796426 | -5.663165 | 0.744622 | other | In6Sb6 | 12 | 63 | 348.09 |
mp-1039242 | -6.436656 | -7.158808 | 1.276896 | other | Mg4Bi2 | 6 | 63 | 156.46 |
mp-1104212 | -5.890145 | -3.639136 | -1.446908 | other | La4Te10 | 14 | 63 | 455.62 |
mp-1185822 | -8.084022 | -6.840485 | 2.339349 | other | Mg2Ag4 | 6 | 63 | 105.93 |
mp-9971 | -6.892073 | -4.581653 | 5.706659 | other | Y2Ge2 | 4 | 63 | 90.81 |
mp-1188109 | -8.130398 | -6.326435 | 5.486436 | other | Ho6In10 | 16 | 63 | 404.53 |
mp-1080793 | -5.633492 | -3.180231 | -1.073723 | original | Pu2Te6 | 8 | 63 | 250.79 |
mp-16342 | -6.956098 | -4.404844 | 5.572664 | other | Ho2Ge2 | 4 | 63 | 88.47 |
mp-864941 | -7.444329 | -5.762392 | 5.356148 | other | Mg2Sc4 | 6 | 63 | 143.76 |
mp-1190232 | -6.948414 | -6.162487 | 3.188612 | other | Yb6Sn10 | 16 | 63 | 440.24 |
mp-1205322 | 3.393864 | -0.720231 | -2.347269 | other | Ca2H4 | 6 | 63 | 67.26 |
mp-1007691 | -7.975366 | -3.903411 | 3.432576 | other | Hf2Pt2 | 4 | 63 | 74.13 |
mp-1016106 | -9.414963 | -5.561125 | 3.678927 | other | Hf2Zn32 | 34 | 63 | 504.89 |
mp-1094170 | -7.054228 | -6.518586 | 6.256715 | other | La4Mg2 | 6 | 63 | 194.38 |
mp-1188947 | -8.049995 | -6.325997 | 5.352416 | other | Nd6In10 | 16 | 63 | 444.7 |
mp-1094460 | -8.495528 | -7.434628 | 3.714483 | other | Mg2Zn4 | 6 | 63 | 104.01 |
mp-1018117 | -7.976025 | -4.479445 | 4.895228 | other | Ce2Rh2 | 4 | 63 | 86.95 |
mp-15671 | -5.368626 | -0.222274 | 3.491382 | other | Re6B2 | 8 | 63 | 99.24 |
mp-1094554 | -6.838579 | -9.801296 | 3.097827 | other | Mg4Sb2 | 6 | 63 | 143.36 |
mp-1185940 | -6.299614 | -7.028161 | 2.373127 | other | Mg2Pb4 | 6 | 63 | 174.58 |
mp-1078795 | -6.732573 | -4.438023 | 5.115191 | other | Tm2Ge6 | 8 | 63 | 159.17 |
mp-1094593 | -6.951712 | -11.031987 | 5.494601 | other | Li2Mg4 | 6 | 63 | 127.16 |
mp-1119 | -5.838875 | -3.667674 | -1.534591 | other | Nd4Te10 | 14 | 63 | 445.2 |
mp-1104400 | -4.085306 | -4.858174 | 5.780288 | other | Na2Si12 | 14 | 63 | 265.77 |
mp-571571 | -5.622286 | -3.642112 | -1.440006 | other | Ce2Te6 | 8 | 63 | 253.18 |
mp-13450 | -5.490435 | -3.458277 | 2.194114 | other | Hf6Sb6 | 12 | 63 | 274.5 |
mp-30564 | -7.083472 | -3.718265 | 5.716229 | other | Th2Co2 | 4 | 63 | 81.56 |
mp-12754 | -8.013179 | -4.509939 | 4.009811 | other | Th2Pt2 | 4 | 63 | 98.73 |
mp-600063 | 15.627431 | 5.665534 | 0.37198 | other | Si24O48 | 72 | 63 | 1,397.07 |
mp-982070 | -7.43299 | -1.397031 | 3.716499 | other | V4Ir4 | 8 | 63 | 109.81 |
mp-2264 | -6.967082 | -4.297677 | 5.526878 | other | Er2Ge2 | 4 | 63 | 87.3 |
mp-973906 | -6.892074 | -4.405169 | 5.371889 | other | Lu2Ge4 | 6 | 63 | 120.06 |
mp-10212 | -6.911991 | -4.062897 | 5.182619 | other | Sc2Ge4 | 6 | 63 | 110.39 |
mp-11302 | -8.007208 | -7.299943 | 4.068182 | other | Ho2Cd6 | 8 | 63 | 184.23 |
mp-560973 | 15.596499 | 5.6728 | 0.343673 | other | Si18O36 | 54 | 63 | 992.34 |
mp-18731 | 9.419438 | 13.289496 | -0.758174 | other | Fe6O8 | 14 | 63 | 144.46 |
mp-1018087 | -8.57557 | -5.899562 | 3.391923 | other | Ce2Au2 | 4 | 63 | 106.64 |
mp-504781 | -1.279356 | 1.897838 | -2.410012 | other | Np2I6 | 8 | 63 | 320.84 |
mp-1189917 | -7.408369 | -7.393867 | 5.193359 | other | Nd6Tl10 | 16 | 63 | 456.71 |
mp-1095654 | -6.610259 | -6.346073 | 3.154004 | other | Si4Ag8 | 12 | 63 | 235.91 |
mp-9970 | -7.12475 | -3.838595 | 5.26807 | other | Sc2Ge2 | 4 | 63 | 76.45 |
mp-1080276 | -4.073318 | -2.815413 | -4.083385 | other | Cs4Se2 | 6 | 63 | 277.81 |
mp-1180757 | 6.209778 | 4.007459 | -3.442479 | other | K2N4 | 6 | 63 | 97.59 |
mp-18680 | -2.663652 | -2.862841 | -5.349908 | other | Tm16S22 | 38 | 63 | 824.08 |
mp-1008505 | -5.494688 | -6.568732 | 3.15141 | other | Ba2Pd2 | 4 | 63 | 124.85 |
mp-999177 | -7.986902 | -6.141917 | 6.153967 | other | Sm2Ga2 | 4 | 63 | 101.46 |
mp-1183366 | -6.993961 | -7.012738 | 3.047953 | other | Ba2Cd6 | 8 | 63 | 257.93 |
mp-1025400 | 1.571436 | 2.581277 | -4.96028 | other | Yb2Cl6 | 8 | 63 | 196.85 |
mp-1047607 | 9.27657 | 2.552149 | 0.008831 | other | Mo2F10 | 12 | 63 | 171.68 |
mp-1018115 | -3.197409 | -2.170218 | -5.573859 | other | Pb2S2 | 4 | 63 | 106.65 |
mp-1188213 | -6.286351 | -0.308658 | 3.453252 | other | Co8Mo12 | 20 | 63 | 285.45 |
mp-2383052 | 10.548394 | 11.167541 | -3.105237 | other | W2O6 | 8 | 63 | 115.57 |
mp-1345171 | 12.875391 | 10.076609 | 0.288659 | other | W10O14 | 24 | 63 | 358.94 |
mp-1078573 | 3.738858 | -0.247169 | -2.360619 | other | Ge2H8 | 10 | 63 | 86.67 |
mp-1078955 | -6.047195 | -7.436169 | 2.688227 | other | Na4Tl4 | 8 | 63 | 235.99 |
mp-849537 | 12.569258 | 13.404568 | -1.734515 | other | V12O22 | 34 | 63 | 395.07 |
mp-1094658 | -7.08794 | -10.627812 | 5.072916 | other | Mg4Ga2 | 6 | 63 | 122.34 |
mp-570403 | -8.104922 | -7.258255 | 3.991016 | other | Tb2Cd6 | 8 | 63 | 187.21 |
mp-1094437 | -7.820695 | -10.614767 | 5.024816 | other | Mg4Zn2 | 6 | 63 | 113.13 |
mp-1212407 | -5.734715 | -4.229776 | 2.358963 | other | Hf6Bi6 | 12 | 63 | 294.82 |
mp-680682 | -6.209212 | -6.107392 | 3.724556 | other | K12Ga52 | 64 | 63 | 1,454.99 |
mp-1041997 | 12.907149 | 11.015405 | -0.907571 | other | Mo2O4 | 6 | 63 | 95.69 |
mp-1064719 | -7.673646 | -5.634027 | 5.795375 | other | La2Ni2 | 4 | 63 | 90.64 |
mp-1025472 | -5.709252 | -3.578681 | -1.04126 | other | Np2Te6 | 8 | 63 | 259.8 |
mp-23202 | -1.190827 | 2.72501 | -2.993957 | other | In2I2 | 4 | 63 | 151.12 |
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