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-1103697 | -6.665092 | -3.763727 | -0.408903 | other | Bi4Pd6Se4 | 14 | 12 | 312.29 |
mp-1227093 | -4.743474 | -1.517378 | 0.696879 | other | Ce1Co16P48 | 65 | 12 | 914.5 |
mp-541183 | -4.551054 | -1.061422 | -3.166134 | other | Ta4Ni2Se14 | 20 | 12 | 458.28 |
mp-1211210 | 8.492788 | 1.212928 | -0.333328 | other | Sr3Rh1F12 | 16 | 12 | 246.29 |
mp-3407 | -5.450106 | -1.724287 | -3.799232 | other | Tl1Cr5Se8 | 14 | 12 | 303.99 |
mp-553121 | 11.247715 | 8.234386 | 2.328806 | other | Sm4I2O4 | 10 | 12 | 220.06 |
mp-1025368 | -4.182685 | -0.011426 | -4.401731 | other | Ti2V1S4 | 7 | 12 | 120.87 |
mp-29770 | -5.970348 | -3.206887 | -2.098061 | other | Na3Mn4Te6 | 13 | 12 | 410.81 |
mp-1303299 | 6.45145 | 14.354297 | -1.793734 | other | Li6Co8O16 | 30 | 12 | 284.36 |
mp-4630 | 8.700428 | 12.707048 | -0.240205 | other | Li4Ru2O6 | 12 | 12 | 105.84 |
mp-766367 | 11.123223 | 10.178715 | 1.92839 | other | Dy10Re4O24 | 38 | 12 | 497.45 |
mp-850556 | 10.68632 | 11.425482 | 3.214957 | other | La3Nb8O24 | 35 | 12 | 511.55 |
mp-780883 | 12.47634 | -0.953676 | 1.094704 | other | Mn6O4F8 | 18 | 12 | 220.43 |
mp-1182685 | 3.348682 | -0.798248 | -2.486932 | other | Ba3H12Ir2 | 17 | 12 | 281.79 |
mp-767763 | 8.107394 | 14.536911 | -1.037567 | other | Li14Mn16O40 | 70 | 12 | 703.89 |
mp-8253 | 9.21172 | 11.196445 | -0.256966 | other | Na5Re1O6 | 12 | 12 | 141.19 |
mp-1220651 | -7.176492 | -0.626603 | 4.411731 | other | Nd2Mn17C2 | 21 | 12 | 265.61 |
mp-989459 | 4.970105 | 2.303155 | -3.214413 | other | B2C3N6 | 11 | 12 | 128.47 |
mp-1192759 | 3.031106 | 3.088542 | -3.972533 | other | Ir3N10Cl10 | 23 | 12 | 689.24 |
mp-1246692 | 1.203545 | 2.443701 | 1.827297 | other | Mg8Mn3N8 | 19 | 12 | 230.11 |
mp-1222729 | -2.141468 | 0.441175 | 2.376309 | other | La1Tb1C4 | 6 | 12 | 93.03 |
mp-755013 | 10.020268 | 12.086481 | 1.022779 | other | Li5Ta1O5 | 11 | 12 | 105.97 |
mp-567997 | -7.6304 | -3.531835 | 5.406297 | other | Sm3Co2Ge4 | 9 | 12 | 175.38 |
mp-1174554 | 6.722358 | 19.649195 | -0.340435 | other | Li10Mn6O16 | 32 | 12 | 285.38 |
mp-1025363 | -3.446655 | 0.461878 | 2.754229 | other | Dy2Mo2C3 | 7 | 12 | 103.27 |
mp-1208210 | 8.430429 | 1.494554 | 0.497388 | original | Tl3As1F6 | 10 | 12 | 338.42 |
mp-1025345 | -5.896282 | -2.343378 | -1.33291 | other | Ti2Cr1Te4 | 7 | 12 | 169.65 |
mp-1176373 | 9.896539 | 9.949235 | -1.084067 | other | Na4Sb8O22 | 34 | 12 | 548.74 |
mp-629690 | -3.549149 | -2.089401 | -5.428104 | other | Bi4Pb6S12 | 22 | 12 | 588.06 |
mp-767945 | 6.748822 | 13.672896 | -1.823032 | other | Mg7Co17O32 | 56 | 12 | 550.17 |
mp-1174401 | 4.207947 | 19.136202 | -1.877915 | other | Li7Co5O12 | 24 | 12 | 207.69 |
mp-1105634 | 7.316059 | 10.615091 | -2.587281 | other | Ni5As2O12 | 19 | 12 | 211.87 |
mp-1216779 | -4.749068 | -2.829461 | -3.985063 | other | Tl1In5Se8 | 14 | 12 | 403.13 |
mp-560584 | 11.180278 | 7.424574 | -2.370516 | other | Si6Ag18O21 | 45 | 12 | 672.04 |
mp-1173890 | 3.881408 | 19.069759 | -1.849398 | other | Li4Co2O6 | 12 | 12 | 105.34 |
mp-1078861 | 6.907543 | 6.164334 | -3.53048 | other | Mg1Br2O6 | 9 | 12 | 149.21 |
mp-1219753 | -6.067818 | -4.636613 | 1.218171 | other | Pr2Nd2Sb8 | 12 | 12 | 360.07 |
mp-753618 | 11.381547 | 12.392929 | 0.036948 | other | Mn9Fe1O10 | 20 | 12 | 229.76 |
mp-1209042 | 3.138175 | 2.683217 | -4.376025 | other | Si6C6Cl18 | 30 | 12 | 860.71 |
mp-1213990 | -7.063112 | -4.658211 | 5.165654 | other | Ce11Ni4Ge6 | 21 | 12 | 493.06 |
mp-1236316 | 7.213653 | 8.306133 | -2.362175 | other | Li1Nd2O6 | 9 | 12 | 163.1 |
mp-30285 | -6.152871 | -2.895216 | 0.551148 | other | Sb16Mo8S8 | 32 | 12 | 779.86 |
mp-1216557 | -7.341952 | -4.975065 | 6.291007 | other | Tm2Al2Ga2 | 6 | 12 | 118.21 |
mp-1226420 | -5.609407 | -3.565342 | 1.075341 | other | Eu3P4Pt4 | 11 | 12 | 262.46 |
mp-1227657 | 10.604791 | 9.905992 | 1.448972 | other | Ca6Mn2O8 | 16 | 12 | 209.03 |
mp-1211034 | 10.779551 | 7.085598 | -1.712287 | other | Mg4Si8O22 | 34 | 12 | 646.37 |
mp-752670 | -4.417612 | -1.021056 | -5.421853 | other | Li6Fe2S6 | 14 | 12 | 247.53 |
mp-766123 | 9.766426 | 8.847677 | 3.127989 | other | Ce8Th2O20 | 30 | 12 | 409.3 |
mp-1394001 | 11.474701 | 12.896787 | -0.353162 | other | Mg2Cr4O8 | 14 | 12 | 155.67 |
mp-1174373 | 6.953765 | 19.79921 | -0.158679 | other | Li8Mn6O14 | 28 | 12 | 261.22 |
mp-1105393 | -5.93889 | -6.095702 | 0.763432 | other | Li7Eu4Bi6 | 17 | 12 | 443.68 |
mp-1226821 | -6.074389 | -5.87121 | 5.071587 | other | Ca2Al2Ga2 | 6 | 12 | 129.88 |
mp-675600 | 7.606058 | 8.669204 | -1.556517 | other | Hf6Pb1O18 | 25 | 12 | 426.13 |
mp-1100494 | 7.038613 | 19.702461 | -0.123447 | other | Li9Mn7O16 | 32 | 12 | 298.82 |
mp-29048 | 9.554372 | 8.585896 | -0.295797 | other | Sr2Bi4O8 | 14 | 12 | 262.47 |
mp-1209658 | -0.547918 | 0.674164 | -2.36384 | other | Pr10C12Br6 | 28 | 12 | 618.6 |
mp-28778 | 8.420414 | 1.104527 | 1.845845 | other | K4Sc4F16 | 24 | 12 | 401.39 |
mp-582828 | -1.414836 | 0.106357 | -2.2517 | other | La6Ge6Cl4 | 16 | 12 | 419.18 |
mp-20938 | -3.94488 | -1.397782 | -5.721219 | other | Rb1In5S8 | 14 | 12 | 338.19 |
mp-753288 | 9.597774 | 1.478796 | 0.15144 | other | Li3V1F8 | 12 | 12 | 158.16 |
mp-1246944 | 4.933254 | 2.249016 | -3.353079 | other | Co2C3N6 | 11 | 12 | 116.45 |
mp-1103520 | -3.384646 | -1.448652 | -5.456562 | other | Cs4Si2S6 | 12 | 12 | 405.35 |
mp-1219382 | -8.163605 | -3.208848 | 5.221554 | other | Sm2Ga18Co6 | 26 | 12 | 435.19 |
mp-1029349 | -3.15956 | -3.772432 | -4.429688 | other | Y4Se3N2 | 9 | 12 | 206.53 |
mp-1246080 | 0.606756 | 2.417145 | 1.944704 | other | Sr3Mn6N6 | 15 | 12 | 194.08 |
mp-9149 | -5.537798 | -3.349976 | 0.585939 | other | Er3P4Pd7 | 14 | 12 | 229.23 |
mp-1104456 | -4.926795 | -5.017812 | 0.321339 | other | Eu4Zn4As6 | 14 | 12 | 329.97 |
mp-753620 | 6.471916 | 13.61284 | -2.308372 | other | Mn1Co3O8 | 12 | 12 | 138.46 |
mp-1402016 | 12.668421 | 10.17774 | 0.40529 | other | Ca2W3O8 | 13 | 12 | 161.34 |
mp-1210652 | 3.524096 | -0.380717 | -2.510257 | other | Mg1H6Br2 | 9 | 12 | 138.64 |
mp-1212136 | 8.287123 | 1.453775 | -0.455768 | other | K3Au1F12 | 16 | 12 | 304.19 |
mp-1174519 | 6.752946 | 19.632669 | -0.339746 | other | Li5Mn3O8 | 16 | 12 | 142.01 |
mp-19081 | 12.024415 | 11.099626 | -3.114034 | other | Mn4Mo4O16 | 24 | 12 | 337.93 |
mp-1025369 | -3.393396 | 0.491554 | 2.761708 | other | Tm2Mo2C3 | 7 | 12 | 99.94 |
mp-1204077 | -6.013174 | -3.769246 | -1.86953 | other | Cs4Bi16Te24 | 44 | 12 | 1,675.18 |
mp-1220676 | -4.467062 | -0.953608 | -3.101588 | other | Nb3Ir1Se8 | 12 | 12 | 277.05 |
mp-1224516 | -6.051396 | -2.443397 | -0.982078 | other | Ge6Te6Ir4 | 16 | 12 | 378.8 |
mp-1078058 | -5.365116 | 0.013402 | -5.495718 | other | Ti1Cr2S4 | 7 | 12 | 123 |
mp-1214504 | -7.449625 | 0.351685 | 5.133366 | other | Ce3Ti6Fe23 | 32 | 12 | 447.38 |
mp-643367 | -0.562282 | 0.689529 | -2.504199 | other | Y2C2Br2 | 6 | 12 | 132.57 |
mp-1281785 | 6.248612 | 13.373083 | -1.365431 | other | Li4Ni4O8 | 16 | 12 | 138.04 |
mp-769466 | 11.773252 | 7.276385 | 0.162702 | other | Y2Ge2O7 | 11 | 12 | 155.22 |
mp-1104829 | -4.574983 | -1.231056 | -2.76951 | other | Nb5Sn1Se8 | 14 | 12 | 296.31 |
mp-1174390 | 4.089053 | 19.650131 | -1.828955 | other | Li8Co6O14 | 28 | 12 | 248.99 |
mp-546035 | 8.033679 | 10.633795 | -3.610269 | other | Cr3Cu1O8 | 12 | 12 | 153.6 |
mp-1225238 | -7.730719 | 1.050057 | 4.959699 | other | Er2Fe17C1 | 20 | 12 | 259.92 |
mp-582245 | -7.244021 | -3.363539 | 5.870766 | other | Ce4Al23Ni6 | 33 | 12 | 553.8 |
mp-1206581 | -7.588041 | -4.034282 | 5.347317 | other | Sm4Ge4Rh2 | 10 | 12 | 216.93 |
mp-887724 | 5.626122 | 11.923358 | -1.813771 | other | Li8Fe4O12 | 24 | 12 | 202.76 |
mp-1206069 | -8.040822 | -5.406292 | 3.307823 | other | Lu3Cu4Sn4 | 11 | 12 | 221.13 |
mp-755484 | 6.323537 | 13.482387 | -2.126924 | other | Co4Ni1O8 | 13 | 12 | 132.94 |
mp-1192861 | -4.087683 | -3.615633 | -2.715779 | other | U8Ni1Se17 | 26 | 12 | 662.63 |
mp-1103869 | -6.456404 | -2.774189 | -1.74177 | other | K1Cr5Te8 | 14 | 12 | 384.38 |
mp-1199723 | -8.260678 | -5.373783 | 3.415315 | other | Ce4In21Pd10 | 35 | 12 | 758.89 |
mp-1219310 | -8.207928 | -3.85129 | 4.663431 | other | Sc2Ga2Ni2 | 6 | 12 | 94.52 |
mp-1291102 | 8.861119 | 12.778939 | -0.823043 | other | Zn4Co4O8 | 16 | 12 | 158.84 |
mp-1216926 | -8.154408 | -4.648103 | 4.697988 | other | Tm6Ga17Pt5 | 28 | 12 | 509.83 |
mp-754198 | -1.184087 | 1.789921 | -1.708375 | other | Ba1La2I8 | 11 | 12 | 454.31 |
mp-1229158 | -5.856485 | -2.998775 | -1.9926 | other | Ag1Te10Au4 | 15 | 12 | 406.76 |
mp-540569 | -5.482789 | -0.096957 | -5.670063 | other | Cs1Cr5S8 | 14 | 12 | 271.49 |
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