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-1080262 | -4.2579 | -4.985667 | -3.421962 | other | Ce8Se16 | 24 | 14 | 1,438.6 |
mp-29179 | 1.411479 | 2.351658 | -5.263388 | other | Sn8Cl16 | 24 | 14 | 665.72 |
mp-734582 | 4.55591 | 2.895956 | -4.174258 | other | C16S48 | 64 | 14 | 1,829.49 |
mp-29502 | -6.058964 | -3.434504 | -2.10286 | other | Al16Te24 | 40 | 14 | 1,396.19 |
mp-1102900 | -3.998219 | -1.249416 | -5.294165 | other | Ag8S4 | 12 | 14 | 265.29 |
mp-1605 | 7.166381 | 9.714958 | -1.816448 | other | Ag6O8 | 14 | 14 | 182.6 |
mp-1021522 | 11.899478 | 13.564484 | -2.495058 | other | V8O16 | 24 | 14 | 260.35 |
mp-540622 | 8.565187 | 1.98822 | -0.708784 | other | Rh8F40 | 48 | 14 | 627.06 |
mp-30954 | -1.168767 | 2.499509 | -2.945817 | other | Ga4I12 | 16 | 14 | 713.51 |
mp-1536 | -5.079339 | -6.149425 | 0.530492 | other | K8Sb8 | 16 | 14 | 618.12 |
mp-1075786 | -3.183305 | -7.705135 | 7.522029 | other | Mg12Si8 | 20 | 14 | 379.83 |
mp-430 | 10.520932 | 12.516942 | 1.844321 | original | Ti4O8 | 12 | 14 | 116.45 |
mp-30930 | -1.163804 | 2.333459 | -2.964902 | other | Al4I12 | 16 | 14 | 725.39 |
mp-1196514 | -2.853032 | -0.634519 | -5.053086 | other | K8S24 | 32 | 14 | 903.07 |
mp-1182259 | 7.122213 | 8.588312 | -1.835115 | other | Ba8O16 | 24 | 14 | 463.46 |
mp-1182915 | 7.647534 | 7.61232 | -4.094331 | other | Al8O24 | 32 | 14 | 470.33 |
mp-755066 | 12.562485 | 7.55715 | 0.511349 | other | Al8O12 | 20 | 14 | 190.14 |
mp-542570 | -4.221437 | -2.486538 | -3.487556 | other | As16Se16 | 32 | 14 | 937.15 |
mp-29767 | -4.932391 | -1.87663 | -3.147656 | other | Pt10Se8 | 18 | 14 | 338.49 |
mp-1182433 | 6.695809 | 6.100749 | -3.739893 | other | Ba4O16 | 20 | 14 | 360.06 |
mp-542630 | -2.479171 | -0.350797 | -5.203565 | other | P16S36 | 52 | 14 | 1,421.25 |
mp-1359089 | -3.359288 | -0.981037 | -5.159526 | other | Sb8S20 | 28 | 14 | 937.72 |
mp-567789 | -1.176818 | 2.523379 | -2.937596 | other | In4I12 | 16 | 14 | 749.48 |
mp-728122 | 8.735885 | 7.94844 | -3.657996 | other | U12O40 | 52 | 14 | 846.46 |
mp-647589 | -6.894337 | -4.537203 | 5.394029 | other | La24Ge44 | 68 | 14 | 1,647.79 |
mp-27647 | 2.012343 | 2.847464 | -4.518796 | other | Au4Cl12 | 16 | 14 | 445.87 |
mp-757854 | 9.896179 | 2.379221 | -0.088705 | other | V4F20 | 24 | 14 | 341.42 |
mp-28223 | -4.261921 | -3.916415 | -3.607336 | other | La4Se8 | 12 | 14 | 345.97 |
mp-1095294 | -3.272027 | -1.725616 | -5.687788 | other | Si4S8 | 12 | 14 | 291.14 |
mp-583714 | 9.765116 | 8.644329 | 2.344393 | other | Pr40O72 | 112 | 14 | 1,853.02 |
mp-726866 | 6.484658 | 5.956565 | -3.736238 | other | N4O8 | 12 | 14 | 249.03 |
mp-759987 | 10.259574 | 0.484844 | -0.058513 | other | Mn8F28 | 36 | 14 | 518.9 |
mp-554340 | 9.902547 | 2.307371 | 1.949679 | other | Cr2F4 | 6 | 14 | 77.88 |
mp-1214152 | 5.334665 | 3.003474 | -4.017947 | other | C8S12 | 20 | 14 | 444.05 |
mp-31104 | -5.542829 | -6.211973 | 0.847247 | other | K16Bi16 | 32 | 14 | 1,317.4 |
mp-1101189 | 9.681723 | 2.285718 | -0.153477 | other | V4F20 | 24 | 14 | 364.33 |
mp-27747 | -1.104991 | 2.292751 | -3.368841 | other | Pd4I8 | 12 | 14 | 410 |
mp-568024 | 1.246889 | 2.553364 | -4.353313 | other | I8Cl8 | 16 | 14 | 579.5 |
mp-1095637 | -3.832366 | -3.921947 | 0.756735 | other | Pr4P8 | 12 | 14 | 265.84 |
mp-974434 | 8.718368 | 2.139273 | -0.506002 | other | Ru2F8 | 10 | 14 | 126.86 |
mp-1214283 | 5.760003 | 2.761085 | -3.498661 | other | C40Cl32 | 72 | 14 | 1,423.98 |
mp-755 | -6.41087 | -3.198465 | 0.733003 | other | Co4Sb8 | 12 | 14 | 240.52 |
mp-1198133 | -5.059895 | -4.502913 | 6.024411 | other | Y20Si16 | 36 | 14 | 845.7 |
mp-7904 | -3.385983 | -3.851988 | 0.508295 | other | Cd2P8 | 10 | 14 | 206.57 |
mp-200 | -3.629713 | -3.939531 | 0.588249 | other | La4P28 | 32 | 14 | 658.73 |
mp-754531 | 12.639061 | 7.466691 | 0.631516 | other | Al8O12 | 20 | 14 | 209.77 |
mp-1201738 | 14.663433 | 5.996067 | -0.075922 | other | Si32O64 | 96 | 14 | 1,138.39 |
mp-978114 | 10.860013 | 9.160203 | 0.024308 | other | Sn10O12 | 22 | 14 | 392.79 |
mp-1103658 | -2.671573 | -2.580761 | -5.490149 | other | La4S8 | 12 | 14 | 279.63 |
mp-561397 | 9.24387 | 5.354687 | -5.839019 | other | S4O12 | 16 | 14 | 213.3 |
mp-568593 | -6.611597 | -3.595144 | 0.156708 | other | Pd68Se22 | 90 | 14 | 1,482.34 |
mp-541341 | 8.405835 | 2.133428 | -0.886656 | other | Pt8F40 | 48 | 14 | 627.43 |
mp-572892 | -3.630723 | -1.413489 | -5.585933 | other | Ge16S32 | 48 | 14 | 1,312.46 |
mp-850131 | -5.375097 | -0.958372 | -4.256063 | other | Ni2S4 | 6 | 14 | 94.35 |
mp-2858 | 10.801333 | 9.929065 | 3.973895 | other | Zr4O8 | 12 | 14 | 141.67 |
mp-1212012 | -4.815375 | -7.208039 | 1.76129 | other | K40Tl28 | 68 | 14 | 3,197.3 |
mp-23288 | -0.293871 | 1.216145 | -4.157107 | other | Al4Br12 | 16 | 14 | 563.94 |
mp-1196387 | -1.976437 | 2.158038 | -3.044677 | other | W24I64 | 88 | 14 | 3,715.79 |
mp-1196867 | 2.323098 | 2.492942 | 0.476332 | other | La8N24 | 32 | 14 | 600.55 |
mp-1320 | -4.097906 | -3.920749 | -3.275501 | other | Ce4Se8 | 12 | 14 | 295.4 |
mp-1204051 | 6.582721 | 6.00959 | -3.825866 | other | Na8O36 | 44 | 14 | 711.01 |
mp-1374127 | 8.821205 | 1.763319 | -0.657207 | other | Cr4F20 | 24 | 14 | 362.75 |
mp-765600 | 9.722849 | 2.281414 | -0.157526 | other | V4F20 | 24 | 14 | 365.35 |
mp-755211 | 7.567358 | 9.638869 | -3.864563 | other | Cr4O12 | 16 | 14 | 298.91 |
mp-1080632 | -4.271023 | -4.98076 | -3.41854 | other | Ce24Se48 | 72 | 14 | 5,611.59 |
mp-1207529 | -5.625383 | -4.164001 | 3.547795 | other | Zr4Pb4 | 8 | 14 | 210.6 |
mp-30970 | -8.270823 | -6.105076 | 6.391339 | other | Er24Co14 | 38 | 14 | 814.05 |
mp-1198148 | 6.683145 | 5.974218 | -3.809682 | other | Ba4O40 | 44 | 14 | 776.88 |
mp-619575 | 8.235909 | 2.808419 | -1.221216 | other | Cl8F24 | 32 | 14 | 491.74 |
mp-769096 | -4.755383 | -1.793508 | 1.076434 | other | Mn6P24 | 30 | 14 | 448.12 |
mp-415 | 0.674793 | 2.253947 | 1.838873 | other | Ir4N8 | 12 | 14 | 112.61 |
mp-29014 | -2.604012 | -0.404939 | -5.03472 | other | P16S24 | 40 | 14 | 1,029.75 |
mp-1194715 | 11.542996 | 8.031641 | -3.133724 | other | As16O24 | 40 | 14 | 667.25 |
mp-630528 | -4.003034 | -1.548732 | -5.738571 | other | In4S4 | 8 | 14 | 188.25 |
mp-570668 | -4.21001 | -3.964418 | -3.618788 | other | La4Se8 | 12 | 14 | 315.67 |
mp-23261 | 7.481158 | 6.33132 | -3.051226 | other | I8O20 | 28 | 14 | 429.71 |
mp-1106184 | -4.117257 | 1.544315 | 2.85233 | other | Mn4B16 | 20 | 14 | 142.99 |
mp-2831849 | 0.738667 | 2.370901 | 1.796893 | other | Rh4N8 | 12 | 14 | 113.87 |
mp-651155 | -1.102849 | 2.170234 | -3.134933 | other | Te16I64 | 80 | 14 | 3,810.02 |
mp-687150 | 8.183455 | 7.966825 | -3.92975 | other | U2O8 | 10 | 14 | 163.52 |
mp-1190908 | -8.159025 | -3.509605 | 4.895101 | other | Ga18Rh4 | 22 | 14 | 359.25 |
mp-7944 | -5.376421 | -6.01081 | 0.535669 | other | Na8Sb8 | 16 | 14 | 477.14 |
mp-636839 | 5.182855 | 3.394998 | -3.536421 | other | Hg4N12 | 16 | 14 | 278.92 |
mp-1237467 | -4.27774 | -4.38302 | -3.378781 | other | Ce16Se32 | 48 | 14 | 1,526.22 |
mp-634117 | 5.633038 | -0.193382 | -3.082503 | other | B4H12 | 16 | 14 | 147.13 |
mp-554799 | 10.173792 | 2.539557 | 0.367507 | other | V2F8 | 10 | 14 | 125.02 |
mp-845 | -8.528747 | -5.059488 | 2.936028 | other | Cu20Sn16 | 36 | 14 | 629.42 |
mp-1182022 | -4.612276 | -3.223371 | -3.556474 | other | Bi4Se4 | 8 | 14 | 271.24 |
mp-559956 | 7.215446 | 8.355942 | -0.809139 | other | Pr40O72 | 112 | 14 | 1,857.25 |
mp-2715 | -6.235378 | -2.054945 | 0.825733 | other | Co4As8 | 12 | 14 | 183.77 |
mp-570796 | 2.195433 | 2.768631 | -4.684571 | other | Sb8Cl40 | 48 | 14 | 1,411.66 |
mp-2084 | -5.986502 | -2.873617 | 5.321391 | other | Si40Ir24 | 64 | 14 | 948.78 |
mp-776688 | 13.140271 | 12.375787 | -0.746681 | other | V8O12 | 20 | 14 | 236.66 |
mp-1176433 | 10.651769 | 0.010345 | 0.252965 | other | Mn4F12 | 16 | 14 | 213.08 |
mp-1178951 | 7.895974 | 8.334488 | -3.595438 | other | Te2O8 | 10 | 14 | 136.77 |
mp-1229 | 9.393398 | 0.729942 | -0.346685 | other | Cu2F4 | 6 | 14 | 68.09 |
mp-27798 | 6.450959 | 0.354369 | -3.435021 | other | B64H80 | 144 | 14 | 1,454.21 |
mp-1268079 | 15.617727 | 5.646859 | 0.346802 | other | Si64O128 | 192 | 14 | 3,976.45 |
mp-1204579 | 5.980991 | 5.313056 | -4.440558 | other | N16O48 | 64 | 14 | 883.81 |
mp-27645 | 1.949654 | 2.748489 | -4.490733 | other | Re8Cl40 | 48 | 14 | 1,430.95 |
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