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-759937 | 10.140801 | 2.463258 | 0.26738 | other | V8F32 | 40 | 33 | 553.69 |
mp-1096913 | 0.694725 | 3.062636 | 1.558971 | other | Cr4N8 | 12 | 33 | 247.22 |
mp-32760 | -3.492178 | -3.927013 | 0.585421 | other | Li4P20 | 24 | 33 | 470.82 |
mp-2412 | -3.507129 | -3.93557 | 0.58861 | other | Li4P20 | 24 | 33 | 460.02 |
mp-1194880 | -1.863336 | 2.211342 | -3.10301 | other | W20I64 | 84 | 33 | 3,524.81 |
mp-29446 | 6.563614 | 0.309649 | -3.517747 | other | B48H64 | 112 | 33 | 1,623.11 |
mp-1180345 | 6.062831 | 5.747057 | -4.402476 | other | N4O16 | 20 | 33 | 247.47 |
mp-1179069 | 8.167112 | 8.730713 | -3.0738 | other | Te8O24 | 32 | 33 | 484.99 |
mp-1188721 | 3.771648 | 3.225533 | -3.510562 | other | I4N16 | 20 | 33 | 511.41 |
mp-28460 | 6.660061 | 5.491903 | -3.179643 | other | Br8O4 | 12 | 33 | 285.75 |
mp-1207479 | 3.587154 | -0.567639 | -2.799344 | other | Zn4H24 | 28 | 33 | 495.89 |
mp-1178977 | 9.008119 | 9.916348 | -2.272164 | other | Te8O24 | 32 | 33 | 404.89 |
mp-651772 | -5.638412 | -3.351469 | -1.176125 | other | U4Te20 | 24 | 33 | 852.52 |
mp-2447 | -3.044143 | -1.664679 | -3.73064 | other | P16Se20 | 36 | 33 | 1,032.7 |
mp-542610 | 11.35808 | 10.888071 | -3.46763 | other | Mo16O44 | 60 | 33 | 949.53 |
mp-1094287 | -6.50037 | -10.979414 | 5.916198 | other | Sr1Mg5 | 6 | 38 | 166.93 |
mp-1094367 | -4.308557 | -3.75623 | 4.57077 | other | Mg5Ti5 | 10 | 38 | 195.01 |
mp-1094366 | -7.793437 | -10.056171 | 6.571365 | other | Mg5Ti1 | 6 | 38 | 130.59 |
mp-1184420 | -5.58401 | -7.301519 | 3.996973 | other | Eu5Mg1 | 6 | 38 | 237.8 |
mp-978274 | -7.094365 | -7.903857 | 3.066259 | other | Mg3Cd3 | 6 | 38 | 126.27 |
mp-1185687 | -7.491374 | -5.578361 | 5.227941 | other | Mg1Sc5 | 6 | 38 | 147.78 |
mp-1094594 | -6.221741 | -9.272514 | 4.465081 | other | Li3Mg3 | 6 | 38 | 125.39 |
mp-1094173 | -7.318834 | -7.592532 | 6.361902 | other | La3Mg3 | 6 | 38 | 182.71 |
mp-1094191 | -8.519638 | -7.286978 | 3.663156 | other | Mg2Zn4 | 6 | 38 | 104.3 |
mp-1219971 | -7.947248 | -4.168154 | 1.605357 | other | P1Pd6 | 7 | 38 | 109.1 |
mp-974974 | -4.203584 | -7.106883 | 2.369529 | other | Rb3Mg3 | 6 | 38 | 325.22 |
mp-1094810 | -6.305517 | -6.086768 | 5.780155 | other | Ce5Mg1 | 6 | 38 | 180.34 |
mp-1094534 | -5.672292 | -5.890717 | 0.46666 | other | Mg3Sb3 | 6 | 38 | 149.12 |
mp-1185830 | -7.176013 | -10.357825 | 4.986323 | other | Mg5In1 | 6 | 38 | 135.34 |
mp-1094732 | -6.607553 | -6.011495 | 5.517183 | other | Ce4Mg2 | 6 | 38 | 159.5 |
mp-1094304 | -4.936598 | -7.480269 | 3.760128 | other | Sr3Mg3 | 6 | 38 | 231.32 |
mp-1094475 | -8.166207 | -9.36778 | 4.442163 | other | Mg6Zn6 | 12 | 38 | 208.89 |
mp-1094672 | -6.637671 | -9.470674 | 4.841785 | other | Mg3Ga3 | 6 | 38 | 120.96 |
mp-704745 | -8.99768 | -4.618911 | 3.086808 | other | Cu8O1 | 9 | 38 | 107.98 |
mp-1094555 | -7.222657 | -11.182182 | 4.586662 | other | Mg5Sb1 | 6 | 38 | 140.61 |
mp-1094434 | -7.419658 | -10.939291 | 5.349325 | other | Mg5Zn1 | 6 | 38 | 123.91 |
mp-642328 | 11.454585 | 9.04658 | 1.722027 | other | U13O34 | 47 | 38 | 731.6 |
mp-1080522 | -7.08044 | -5.739728 | 3.323694 | other | Y2Sn6 | 8 | 38 | 220.17 |
mp-1038760 | -5.157804 | -7.348798 | 3.959743 | other | Ca8Mg4 | 12 | 38 | 425.9 |
mp-1094385 | -4.354036 | -3.731369 | 4.555492 | other | Mg3Ti3 | 6 | 38 | 117.58 |
mp-1186449 | -6.16567 | -2.701818 | 4.324482 | other | Pa1V1 | 2 | 38 | 38.31 |
mp-1094482 | -7.708293 | -9.950959 | 6.757678 | other | Y1Mg5 | 6 | 38 | 147.11 |
mp-1094647 | -7.057397 | -10.67032 | 5.081937 | other | Mg4Ga2 | 6 | 38 | 123.88 |
mp-977250 | -6.99647 | -7.216655 | 6.860182 | original | Pm5Mg1 | 6 | 38 | 197.42 |
mp-1038987 | -6.73493 | -10.755924 | 5.965997 | other | Ca2Mg10 | 12 | 38 | 310.75 |
mp-1094488 | -8.040923 | -9.646108 | 4.385936 | other | Mg3Zn3 | 6 | 38 | 111.04 |
mp-1039565 | -7.768874 | -9.670271 | 6.50469 | other | Ce2Mg10 | 12 | 38 | 291.29 |
mp-1185874 | -5.571437 | -5.193491 | 3.095827 | other | Mg1Ge5 | 6 | 38 | 115.19 |
mp-1039419 | -6.101019 | -6.006563 | 0.490829 | other | Mg6Bi6 | 12 | 38 | 336.52 |
mp-623460 | -7.02988 | -5.841846 | 3.133169 | other | Gd2Sn6 | 8 | 38 | 238.68 |
mp-1094251 | -6.809517 | -9.33455 | 3.412966 | other | Mg3Sn3 | 6 | 38 | 148.61 |
mp-1094465 | -7.651802 | -10.822298 | 4.966476 | other | Mg4Zn2 | 6 | 38 | 119.13 |
mp-1094512 | -6.840142 | -9.947377 | 3.139883 | other | Mg4Sb2 | 6 | 38 | 145.82 |
mp-1094237 | -6.161213 | -4.30842 | 3.213276 | other | Zr5Sn5 | 10 | 38 | 233.62 |
mp-1094205 | -7.091603 | -10.820286 | 4.8438 | other | Mg5Sn1 | 6 | 38 | 137.33 |
mp-1185698 | -6.324634 | -5.640644 | 0.454574 | other | Mg1Bi5 | 6 | 38 | 187.69 |
mp-1094484 | -9.223434 | -5.986614 | 3.4287 | other | Mg1Zn5 | 6 | 38 | 91.03 |
mp-1094714 | -7.291353 | -11.180445 | 4.347948 | other | Mg5Bi1 | 6 | 38 | 143.53 |
mp-1078505 | -7.070822 | -5.712842 | 3.361175 | other | Dy2Sn6 | 8 | 38 | 217.51 |
mp-1094648 | -6.685744 | -9.593482 | 4.855779 | other | Mg3Ga3 | 6 | 38 | 121.13 |
mp-1094637 | -6.679203 | -9.559192 | 4.862666 | other | Mg3Ga3 | 6 | 38 | 118.86 |
mp-1079543 | -3.344196 | -2.137433 | -5.513012 | other | Pb4S4 | 8 | 38 | 258.14 |
mp-1094357 | -4.311907 | -3.749082 | 4.563221 | other | Mg5Ti5 | 10 | 38 | 197.74 |
mp-1038944 | -7.053995 | -7.897764 | 3.021553 | other | Mg6Cd6 | 12 | 38 | 256.76 |
mp-1094525 | -6.918567 | -10.443917 | 4.232833 | other | Mg4Sn2 | 6 | 38 | 143.07 |
mp-1079474 | -7.114367 | -5.693471 | 3.297889 | other | Er2Sn6 | 8 | 38 | 216.51 |
mp-1038799 | -6.112687 | -6.027354 | 0.504137 | other | Mg6Bi6 | 12 | 38 | 337.97 |
mp-632475 | -3.966519 | -0.090858 | -3.902764 | other | Nb1S2 | 3 | 38 | 56.01 |
mp-1094409 | -7.869328 | -9.520767 | 6.976879 | other | Y2Mg4 | 6 | 38 | 161.3 |
mp-1185804 | -6.99054 | -10.770567 | 4.899746 | other | Mg5Ge1 | 6 | 38 | 129.09 |
mp-1094562 | -5.740627 | -7.129018 | 3.53479 | other | Li4Mg2 | 6 | 38 | 123.86 |
mp-1038761 | -6.100093 | -5.979484 | 0.500041 | other | Mg6Bi6 | 12 | 38 | 335.1 |
mp-1094399 | -4.321334 | -3.769008 | 4.567214 | other | Mg3Ti3 | 6 | 38 | 118.19 |
mp-1094545 | -5.766361 | -5.525207 | 0.452323 | other | Mg2Sb4 | 6 | 38 | 154.34 |
mp-1186288 | -7.262303 | -6.845425 | 7.105226 | other | Nd5Mg1 | 6 | 38 | 201.46 |
mp-1094313 | -4.847067 | -7.449167 | 3.54989 | other | Sr4Mg2 | 6 | 38 | 260.65 |
mp-1185805 | -7.425782 | -10.413778 | 4.850865 | other | Mg5Hg1 | 6 | 38 | 129.15 |
mp-1094815 | -7.729053 | -8.587852 | 6.119284 | other | Ce2Mg4 | 6 | 38 | 150.8 |
mp-1094906 | -5.113919 | -7.349619 | 3.829289 | other | Ca5Mg1 | 6 | 38 | 237 |
mp-1180954 | -3.896414 | -7.194613 | 2.010328 | other | K6Tc3 | 9 | 38 | 284.99 |
mp-1186744 | -7.236828 | -6.899392 | 7.285968 | other | Pr5Mg1 | 6 | 38 | 205.82 |
mp-1094340 | -5.33342 | -3.102839 | 3.967357 | other | Mg1Ti5 | 6 | 38 | 107.56 |
mp-1094626 | -7.306322 | -10.842891 | 5.295851 | other | Mg5Ga1 | 6 | 38 | 126.04 |
mp-1187320 | -7.167418 | -6.667553 | 6.916342 | other | Tb5Mg1 | 6 | 38 | 185.32 |
mp-1094522 | -7.322106 | -6.81203 | 6.670311 | other | Y4Mg2 | 6 | 38 | 179.81 |
mp-1039186 | -7.083265 | -7.993504 | 3.112017 | other | Mg6Cd6 | 12 | 38 | 251.83 |
mp-1183830 | -7.397318 | -6.865451 | 7.113087 | other | Dy5Mg1 | 6 | 38 | 183.22 |
mp-1185098 | -6.801221 | -6.556773 | 6.38844 | other | La5Mg1 | 6 | 38 | 209.81 |
mp-1039711 | -7.011994 | -6.212363 | 5.490262 | other | Ce6Mg6 | 12 | 38 | 316.54 |
mp-1185829 | -7.721818 | -9.77905 | 6.44103 | other | Mg5Sc1 | 6 | 38 | 137.75 |
mp-1022963 | 7.68205 | 9.406844 | -3.086848 | other | Ir2O6 | 8 | 38 | 98.93 |
mp-1185802 | -7.383619 | -10.328805 | 4.738386 | other | Mg5Ag1 | 6 | 38 | 124.16 |
mp-1220181 | -5.049645 | -4.363983 | 6.216177 | other | Nd4Si5 | 9 | 38 | 213.27 |
mp-1008823 | 0.688356 | 2.154158 | 2.100294 | other | Os1N2 | 3 | 38 | 29.38 |
mp-1039395 | -6.097999 | -5.996603 | 0.467136 | other | Mg6Bi6 | 12 | 38 | 325.15 |
mp-1094311 | -6.071548 | -10.682644 | 5.649574 | other | Sr2Mg4 | 6 | 38 | 201.27 |
mp-1187658 | -7.521233 | -6.818644 | 7.049796 | other | Tm5Mg1 | 6 | 38 | 175.7 |
mp-1094453 | -7.724545 | -8.58908 | 6.857145 | other | Y3Mg3 | 6 | 38 | 167.72 |
mp-2415538 | -8.109477 | -9.575745 | 4.526536 | other | Mg3Zn3 | 6 | 38 | 113.57 |
mp-1094200 | -6.808075 | -9.34256 | 3.394214 | other | Mg3Sn3 | 6 | 38 | 147.55 |
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