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-1225716 | -9.64926 | -4.687024 | 3.991865 | other | Dy3Cu21 | 24 | 47 | 346.65 |
mp-554867 | 10.888071 | 11.784703 | 2.840366 | other | Ta2O5 | 7 | 47 | 94 |
mp-1220312 | 9.69884 | 8.439399 | 2.721822 | other | Nd2O3 | 5 | 47 | 95.8 |
mp-1178625 | -2.223901 | -8.358365 | 2.259903 | other | Zr3Cd2 | 5 | 47 | 3,017.76 |
mp-1224497 | -4.095374 | -4.909422 | 5.60252 | other | K15Si92 | 107 | 47 | 2,214.08 |
mp-1217092 | -6.054638 | -2.636206 | 4.963586 | other | Ti3Al5 | 8 | 47 | 126.57 |
mp-1216893 | -5.09551 | -3.528152 | 3.511249 | other | U7Mo1 | 8 | 47 | 158.36 |
mp-1205213 | 15.375419 | 5.741166 | 0.243089 | other | Si72O144 | 216 | 47 | 4,019.25 |
mp-999545 | -7.31496 | -0.6247 | 4.131058 | other | Mn3Fe1 | 4 | 47 | 53.51 |
mp-683970 | 15.466081 | 5.630996 | 0.24073 | other | Si64O128 | 192 | 47 | 4,113.75 |
mp-555676 | 15.141073 | 5.833779 | 0.013692 | other | Si8O16 | 24 | 48 | 354.39 |
mp-1080364 | -4.288999 | -4.903897 | -3.401397 | other | Ce8Se16 | 24 | 48 | 1,604.59 |
mp-1080357 | -4.27118 | -4.914853 | -3.387445 | other | Ce8Se16 | 24 | 50 | 1,490.92 |
mp-558366 | 13.768097 | 6.067103 | -0.822652 | other | Si8O16 | 24 | 50 | 333.9 |
mp-1212122 | 1.340338 | 2.371162 | -5.334752 | other | In8Cl16 | 24 | 52 | 760.55 |
mp-27398 | -0.178533 | 1.331499 | -4.343592 | other | Tl8Br16 | 24 | 52 | 892.56 |
mp-568108 | -0.439678 | 1.175088 | -4.241811 | other | In8Br16 | 24 | 52 | 873.78 |
mp-1179587 | 10.077672 | 9.944417 | -0.69006 | other | Sb8O16 | 24 | 52 | 355.21 |
mp-28384 | -0.363358 | 1.294493 | -4.336133 | other | Ga8Br16 | 24 | 52 | 782.25 |
mp-560098 | 10.01578 | 9.927869 | -0.654107 | other | Sb8O16 | 24 | 52 | 314.59 |
mp-754658 | 9.262484 | 10.149817 | -2.182461 | other | Te4O12 | 16 | 52 | 205.41 |
mp-31150 | -5.887487 | -6.122242 | 0.937336 | other | Sr8Bi12 | 20 | 52 | 717.47 |
mp-568848 | 1.619024 | 2.478582 | -5.269969 | other | Ga8Cl16 | 24 | 52 | 661.81 |
mp-29312 | -1.200209 | 2.674531 | -2.937271 | other | In8I16 | 24 | 52 | 1,072.37 |
mp-1188663 | -7.933008 | -4.72483 | 1.825552 | other | Pd10Pb6 | 16 | 5 | 311.75 |
mp-557134 | 15.491354 | 5.67172 | 0.249206 | other | Si4O8 | 12 | 5 | 173.92 |
mp-1096888 | 0.676747 | 3.130585 | 1.503944 | other | Cr4N8 | 12 | 5 | 210.1 |
mp-1074287 | -2.989481 | -7.596164 | 7.521142 | other | Mg8Si6 | 14 | 5 | 262.92 |
mp-2646975 | 7.408077 | 6.386487 | -4.084312 | other | Al2O6 | 8 | 5 | 82.01 |
mp-568524 | -8.529168 | -5.057281 | 2.938637 | other | Cu15Sn12 | 27 | 5 | 471.02 |
mp-1272932 | 12.02909 | 13.474701 | -2.380102 | other | V6O12 | 18 | 5 | 213.79 |
mp-1080270 | -4.266268 | -4.952525 | -3.417754 | other | Ce4Se8 | 12 | 5 | 671.93 |
mp-1100796 | 6.099598 | 8.982326 | -2.102329 | other | Pb7O16 | 23 | 5 | 343.66 |
mp-556553 | 14.983259 | 5.908086 | 0.079573 | other | Si4O8 | 12 | 5 | 155.92 |
mp-684652 | 8.925229 | 1.201907 | 0.979559 | other | Be3F6 | 9 | 5 | 187.8 |
mp-1217269 | -4.349501 | -2.342204 | -3.394498 | other | Te1Se2 | 3 | 5 | 93.4 |
mp-756900 | 6.333777 | 13.511744 | -2.340095 | other | Co7O12 | 19 | 5 | 199 |
mp-1094349 | -4.310445 | -3.756253 | 4.578662 | other | Mg3Ti3 | 6 | 5 | 116.1 |
mp-1080319 | -3.988785 | -2.563281 | -3.063837 | other | Ce1Se2 | 3 | 5 | 181.04 |
mp-10426 | 11.108977 | 11.982658 | 2.4202 | other | Nb2O5 | 7 | 5 | 83.3 |
mp-1178425 | 9.39334 | 0.963324 | -0.838473 | other | Co3F9 | 12 | 5 | 152.84 |
mp-754451 | 10.265625 | 12.344757 | -4.099329 | other | V5O12 | 17 | 5 | 236.07 |
mp-685164 | 13.293461 | 11.947599 | -0.380642 | other | V25O32 | 57 | 5 | 646.62 |
mp-715572 | 8.503848 | 13.335283 | -1.205075 | other | Fe16O24 | 40 | 5 | 409.03 |
mp-1173070 | -5.500925 | -3.000665 | -4.506199 | other | Cu9Se5 | 14 | 5 | 249.32 |
mp-673174 | -6.921701 | 0.697474 | 3.833216 | other | Fe24N9 | 33 | 5 | 327.27 |
mp-1039505 | -6.940552 | -6.41359 | 5.513341 | other | Ce3Mg3 | 6 | 5 | 166.19 |
mp-1039236 | -6.102205 | -6.012144 | 0.489854 | other | Mg3Bi3 | 6 | 5 | 168.44 |
mp-556662 | 15.306623 | 5.777072 | 0.250066 | other | Si4O8 | 12 | 5 | 171.58 |
mp-1096894 | 0.660217 | 3.153541 | 1.502867 | other | Cr4N8 | 12 | 5 | 190.08 |
mp-726032 | -4.509332 | -2.303088 | -3.535893 | other | K2Se6 | 8 | 5 | 293.28 |
mp-684604 | -4.076311 | -1.071067 | -5.239108 | other | Cu1S2 | 3 | 5 | 59.96 |
mp-32905 | 7.724426 | 10.825064 | -0.929863 | other | Cu8O7 | 15 | 5 | 172.98 |
mp-685126 | -4.700043 | -1.738084 | -5.811673 | other | Cu39S20 | 59 | 5 | 856.62 |
mp-935148 | -8.6457 | -7.368563 | 3.85161 | other | Mg20Zn35 | 55 | 5 | 940.03 |
mp-656097 | 4.959694 | 3.092426 | -3.418531 | other | Ca2N12 | 14 | 5 | 192.28 |
mp-1080329 | -4.263366 | -4.970559 | -3.419089 | other | Ce4Se8 | 12 | 5 | 793.59 |
mp-1271729 | 9.79035 | 13.097933 | -0.809926 | other | Fe12O16 | 28 | 5 | 315.58 |
mp-1314858 | 11.892896 | 13.581744 | -2.478073 | other | V6O12 | 18 | 5 | 215.87 |
mp-561320 | -3.291222 | -2.105945 | -5.548253 | other | Pb2S2 | 4 | 5 | 395.49 |
mp-1216489 | -3.058399 | -2.050331 | -5.08681 | other | Yb10S18 | 28 | 5 | 682.04 |
mp-673168 | 14.692382 | 6.006256 | -0.198397 | other | Si3O6 | 9 | 5 | 204.11 |
mp-1094164 | -7.274984 | -7.506785 | 6.323043 | other | La3Mg3 | 6 | 5 | 183.73 |
mp-1075513 | -2.144239 | -5.861369 | 7.472278 | other | Mg10Si12 | 22 | 5 | 410.63 |
mp-1220037 | -2.660216 | -2.677315 | -5.652145 | other | Pr10S18 | 28 | 5 | 657.55 |
mp-1106111 | -7.741093 | -1.659112 | 2.502612 | other | Ni10Ge6 | 16 | 5 | 198.44 |
mp-685066 | -3.085089 | -2.524379 | -3.975938 | other | U5S10 | 15 | 5 | 289.41 |
mp-1080121 | -4.47147 | -2.359097 | -3.468835 | other | K2Se6 | 8 | 5 | 249.2 |
mp-1094523 | -7.699776 | -8.490664 | 6.825138 | other | Y3Mg3 | 6 | 5 | 167.56 |
mp-1274098 | 12.93941 | 13.096077 | -1.130241 | other | V6O10 | 16 | 5 | 173.96 |
mp-1094238 | -6.806721 | -9.388303 | 3.402913 | other | Mg3Sn3 | 6 | 5 | 148.3 |
mp-624688 | 11.139742 | 12.053185 | 2.369638 | other | Ta2O5 | 7 | 5 | 81.67 |
mp-1179500 | 8.574944 | 1.257977 | 1.647633 | other | Sc1F3 | 4 | 5 | 53.02 |
mp-632403 | 1.403236 | 2.382609 | -5.328776 | other | Cd1Cl2 | 3 | 5 | 87.44 |
mp-729507 | 1.757618 | 2.647503 | -4.593155 | other | Ir4Cl12 | 16 | 5 | 387.89 |
mp-1218194 | 10.970858 | 12.006732 | 2.964348 | other | Ta6O15 | 21 | 5 | 313.23 |
mp-1194011 | 6.661452 | 6.02899 | -4.045414 | other | S2O24 | 26 | 5 | 577.74 |
mp-1178540 | 6.101319 | 13.270345 | -2.573852 | other | Co8O16 | 24 | 5 | 268.93 |
mp-1219223 | -8.19698 | -4.575334 | 2.067052 | other | Sn26Pd40 | 66 | 5 | 1,190.58 |
mp-1094533 | -5.547297 | -5.915437 | 0.389043 | other | Mg3Sb3 | 6 | 5 | 154.31 |
mp-1204035 | -1.884126 | 2.209574 | -3.105735 | other | W15I47 | 62 | 5 | 2,637.61 |
mp-1235185 | 6.57644 | 5.646575 | -3.608725 | other | Li1O8 | 9 | 5 | 100.41 |
mp-1094445 | -8.101546 | -9.570746 | 4.416692 | other | Mg3Zn3 | 6 | 5 | 110.8 |
mp-30082 | -7.742699 | -1.680247 | 2.50833 | other | Ni19Ge12 | 31 | 5 | 393.45 |
mp-530050 | 8.825483 | 13.190749 | -1.265037 | other | Fe43O64 | 107 | 5 | 1,241.32 |
mp-1080266 | -4.251994 | -4.982738 | -3.418396 | other | Ce4Se8 | 12 | 5 | 820.2 |
mp-1095012 | -6.110013 | -6.023228 | 0.502316 | other | Mg3Bi3 | 6 | 5 | 168.72 |
mp-1039246 | -7.078458 | -8.028482 | 3.10878 | other | Mg3Cd3 | 6 | 5 | 126.89 |
mp-1219006 | -7.998729 | -5.056489 | 2.297359 | other | Sn7Pd5 | 12 | 5 | 257.09 |
mp-1094589 | -6.236137 | -9.296567 | 4.494694 | other | Li3Mg3 | 6 | 5 | 125.07 |
mp-634805 | 9.051128 | 2.08856 | 1.592952 | other | Sc1F3 | 4 | 5 | 43.37 |
mp-634410 | 5.543951 | 3.253436 | -3.445814 | other | Na1N3 | 4 | 5 | 50.31 |
mp-1173333 | 10.537523 | 10.738936 | -2.757308 | other | Re3O10 | 13 | 5 | 217.29 |
mp-849596 | 8.349989 | 14.351741 | -1.61276 | other | Mn21O40 | 61 | 5 | 720.18 |
mp-1220359 | -2.762539 | -2.666718 | -5.639195 | other | Nd10S18 | 28 | 5 | 641.56 |
mp-551905 | 7.870254 | 8.831736 | -3.609018 | other | Os1O4 | 5 | 5 | 96.17 |
mp-1094306 | -4.94601 | -7.46295 | 3.799828 | other | Sr3Mg3 | 6 | 5 | 225.67 |
mp-1217676 | -4.161483 | -4.208969 | -3.683641 | other | Tb24Se45 | 69 | 5 | 1,648.62 |
mp-1094661 | -6.605302 | -9.175147 | 4.799685 | other | Mg3Ga3 | 6 | 5 | 113.42 |
mp-684588 | -3.400134 | -3.955883 | 0.610684 | other | Sn3P4 | 7 | 5 | 189.42 |
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