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-603694 | 3.028522 | 2.412125 | 1.691521 | other | Si12N16 | 28 | 159 | 290.12 |
mp-672289 | 2.736532 | 2.437899 | 1.618302 | other | Ge12N16 | 28 | 159 | 348.22 |
mp-651332 | -0.534464 | 1.441168 | -3.977387 | other | Se16Br64 | 80 | 159 | 3,159.45 |
mp-1178247 | 12.213779 | 11.774345 | -0.081232 | other | Fe12O12 | 24 | 159 | 257.33 |
mp-1015065 | 0.534968 | 2.381203 | 2.111419 | other | Cr12N16 | 28 | 159 | 339.24 |
mp-764115 | 10.321649 | 12.510671 | -4.138598 | other | V18O42 | 60 | 159 | 1,009.66 |
mp-1080190 | 1.47072 | 1.89039 | 2.386856 | other | Ti12N16 | 28 | 159 | 399.49 |
mp-2245 | 2.972032 | 2.341357 | 1.690594 | other | Si12N16 | 28 | 159 | 292.43 |
mp-1216517 | -3.497025 | 1.822297 | 2.866335 | other | V3B100 | 103 | 16 | 783.84 |
mp-1104513 | 6.07986 | 2.756692 | -2.822942 | other | C11N4 | 15 | 16 | 91.52 |
mp-650841 | -0.362898 | 1.30021 | -4.344272 | other | Ga12Br24 | 36 | 161 | 1,187.86 |
mp-31135 | -3.542621 | -5.331826 | 6.122486 | other | Si38Te16 | 54 | 161 | 1,176.03 |
mp-1172859 | 7.706011 | 5.425136 | -3.390498 | other | P8O20 | 28 | 161 | 502.59 |
mp-669525 | -7.154657 | -4.224906 | 0.970865 | other | Sb12Pd32 | 44 | 161 | 791.69 |
mp-570738 | -1.142203 | 2.58191 | -3.003596 | other | Ga12I24 | 36 | 161 | 1,479.44 |
mp-651723 | 4.56657 | 2.407171 | -3.355851 | other | C10N8 | 18 | 161 | 278.58 |
mp-556660 | 5.028449 | 3.781056 | -4.521797 | other | C8O8 | 16 | 161 | 361.27 |
mp-562613 | 13.494057 | 7.207311 | -6.138017 | other | P8O20 | 28 | 161 | 405.21 |
mp-1063678 | 4.760393 | -0.177672 | -2.768554 | other | H3S1 | 4 | 160 | 32.2 |
mp-574663 | -1.186145 | 2.844837 | -3.005531 | other | Cd4I8 | 12 | 160 | 508.81 |
mp-32899 | -3.92727 | -1.440792 | -5.561167 | other | Li22S11 | 33 | 160 | 508.28 |
mp-1224319 | -4.820799 | -4.548134 | 0.099617 | other | Ge1As3 | 4 | 160 | 90.08 |
mp-1188728 | -1.207318 | 2.840051 | -3.007005 | other | Cd6I12 | 18 | 160 | 696.46 |
mp-1226960 | -6.625288 | -6.280868 | 6.24689 | other | Ce3Er3 | 6 | 160 | 182.15 |
mp-755483 | 12.595924 | 7.463031 | 0.416596 | other | Al2O3 | 5 | 160 | 45 |
mp-1200836 | -4.844029 | -1.790367 | -6.731539 | other | Zn18S18 | 36 | 160 | 735.02 |
mp-1079661 | 5.644571 | 2.085627 | -2.568092 | other | B1C7 | 8 | 160 | 47.49 |
mp-581412 | -4.841445 | -1.784537 | -6.727222 | other | Zn12S12 | 24 | 160 | 486.9 |
mp-581601 | -4.841522 | -1.78473 | -6.727341 | other | Zn12S12 | 24 | 160 | 486.99 |
mp-1224383 | 0.854645 | 1.21656 | 2.752379 | other | Hf3N2 | 5 | 160 | 70.11 |
mp-1220129 | -7.117048 | -6.939104 | 7.387106 | other | Nd3Dy3 | 6 | 160 | 202.51 |
mp-1060143 | -4.903842 | -6.433118 | 3.877441 | other | Sr1U1 | 2 | 160 | 116.79 |
mp-1228795 | -3.786031 | -4.005345 | 0.248071 | other | As1P1 | 2 | 160 | 39.12 |
mp-559374 | -3.92704 | -0.45872 | -4.474831 | other | Ti1S3 | 4 | 160 | 126.38 |
mp-1196782 | -4.84168 | -1.786435 | -6.727883 | other | Zn18S18 | 36 | 160 | 732.06 |
mp-1044721 | 9.897696 | 9.807345 | -0.255944 | other | Sn4O8 | 12 | 160 | 163.11 |
mp-1219744 | -6.952517 | -6.89835 | 7.338274 | other | Pr3Y3 | 6 | 160 | 210.75 |
mp-555280 | -4.841977 | -1.743625 | -6.705402 | other | Zn6S6 | 12 | 160 | 234.59 |
mp-1080242 | 6.734411 | 4.297774 | -3.693574 | other | Pb3N4 | 7 | 160 | 142.03 |
mp-1222489 | -6.316507 | -6.086378 | 3.898016 | other | Li3Ga14 | 17 | 160 | 335.3 |
mp-9813 | -6.07618 | 2.233654 | -5.410832 | other | W1S2 | 3 | 160 | 57.01 |
mp-1197730 | -1.155769 | 0.551096 | 2.362277 | other | Si17C17 | 34 | 160 | 350.67 |
mp-570572 | 6.110172 | 2.256718 | -3.207948 | other | C3N4 | 7 | 160 | 70.75 |
mp-1057015 | -3.205872 | -2.168849 | -5.558885 | original | Pb1S1 | 2 | 160 | 53.37 |
mp-13150 | 3.191987 | 2.478979 | 0.594564 | other | B1N1 | 2 | 160 | 18.29 |
mp-684606 | -5.527496 | -2.933049 | -4.299048 | other | Cu27Se20 | 47 | 160 | 909.83 |
mp-1227319 | -6.310104 | -5.560687 | 0.413142 | other | Bi3Sb1 | 4 | 160 | 141.43 |
mp-554405 | -4.844206 | -1.746344 | -6.712151 | other | Zn5S5 | 10 | 160 | 195.64 |
mp-543011 | -4.844667 | -1.786363 | -6.732447 | other | Zn7S7 | 14 | 160 | 284.34 |
mp-1060884 | -5.788211 | -4.157527 | 3.541303 | other | U1Cd1 | 2 | 160 | 47.06 |
mp-1218000 | -4.240238 | -0.367664 | 3.123444 | other | Ta4C3 | 7 | 160 | 86.28 |
mp-1200848 | -1.11072 | 0.597826 | 2.33453 | other | Si25C25 | 50 | 160 | 525.08 |
mp-1066400 | 4.853961 | 3.036547 | -3.342582 | other | Na1N3 | 4 | 160 | 62 |
mp-19907 | -4.757771 | -2.729315 | -3.900455 | other | In2Se3 | 5 | 160 | 145.66 |
mp-9947 | -1.155979 | 0.563205 | 2.359862 | other | Si7C7 | 14 | 160 | 144.4 |
mp-1202959 | -4.844012 | -1.790329 | -6.731514 | other | Zn18S18 | 36 | 160 | 734.99 |
mp-7581 | -6.557049 | 1.427207 | -3.98638 | other | Mo1Se2 | 3 | 160 | 65.49 |
mp-1201781 | -4.841695 | -1.786474 | -6.727906 | other | Zn18S18 | 36 | 160 | 732.09 |
mp-1434 | -5.219835 | 1.462902 | -4.359889 | other | Mo1S2 | 3 | 160 | 56.92 |
mp-1199343 | -4.842645 | -1.787016 | -6.72944 | other | Zn18S18 | 36 | 160 | 732.32 |
mp-19954 | -6.618294 | -1.698447 | 5.693572 | other | Al16Cr10 | 26 | 160 | 373.36 |
mp-1221203 | -6.102504 | -7.410755 | 2.524355 | other | Na3Tl4 | 7 | 160 | 217.66 |
mp-570804 | -1.112682 | 0.603675 | 2.334242 | other | Si13C13 | 26 | 160 | 273.17 |
mp-684964 | -4.448662 | -1.265566 | -5.234226 | other | Cu11S20 | 31 | 160 | 653.17 |
mp-1218916 | -5.546238 | -5.846012 | 0.656399 | other | Sn1Sb1 | 2 | 160 | 75.78 |
mp-1094692 | -5.960209 | -8.086624 | 5.637898 | other | Mg16Al13 | 29 | 160 | 576.02 |
mp-1044722 | 6.446984 | 8.913274 | -1.328213 | other | Bi4O8 | 12 | 160 | 174.1 |
mp-11713 | -1.155818 | 0.555775 | 2.361305 | other | Si5C5 | 10 | 160 | 103.14 |
mp-1443203 | 5.355813 | 11.217507 | -2.325999 | other | Fe4O8 | 12 | 160 | 143.98 |
mp-1044716 | 10.171654 | 9.839836 | -0.804628 | other | Sb4O8 | 12 | 160 | 227.37 |
mp-1080305 | -4.239807 | -4.436757 | -3.408379 | other | Ce2Se4 | 6 | 160 | 200.88 |
mp-1227290 | -6.182539 | -5.494906 | 0.438793 | other | Bi1Sb1 | 2 | 160 | 68.25 |
mp-1222239 | -9.048869 | -1.561937 | 2.745249 | other | Pr31Ni64 | 95 | 160 | 1,585.65 |
mp-1216778 | -3.910666 | -0.30936 | -4.571764 | other | Ti4S8 | 12 | 160 | 261.3 |
mp-581602 | -4.842666 | -1.785019 | -6.729186 | other | Zn12S12 | 24 | 160 | 486.98 |
mp-1070456 | 2.460658 | 2.411871 | 1.38352 | other | Be3N2 | 5 | 160 | 33.98 |
mp-1201158 | -4.84474 | -1.790383 | -6.732706 | other | Zn18S18 | 36 | 160 | 734.84 |
mp-1220969 | -3.99993 | -4.896727 | 5.648184 | other | Na1Si68 | 69 | 160 | 1,596.86 |
mp-1547 | -5.500631 | -1.042555 | -3.925152 | other | Ni3S3 | 6 | 160 | 81.53 |
mp-1408285 | 10.868598 | 12.460534 | 2.043722 | other | Ti4O8 | 12 | 160 | 149.48 |
mp-581476 | -4.841702 | -1.785181 | -6.727629 | other | Zn12S12 | 24 | 160 | 487.23 |
mp-1091371 | 9.535667 | 8.581544 | -0.561668 | other | Bi4O6 | 10 | 160 | 182.68 |
mp-22691 | -4.820639 | -2.724556 | -4.072642 | other | In2Se2 | 4 | 160 | 122.08 |
mp-1011374 | -4.227252 | -4.363214 | -3.398655 | other | Ce1Se2 | 3 | 160 | 92.33 |
mp-1226250 | -6.108247 | -0.777201 | 3.53879 | other | Cr1Mo3 | 4 | 160 | 61.16 |
mp-555858 | -4.842865 | -1.787564 | -6.729471 | other | Zn10S10 | 20 | 160 | 407.05 |
mp-557151 | -4.841044 | -1.782231 | -6.726592 | other | Zn8S8 | 16 | 160 | 323.74 |
mp-1225318 | -7.30018 | -0.808424 | 3.978442 | other | Mn39In13 | 52 | 160 | 788.85 |
mp-32750 | -1.307642 | 2.510764 | -3.242153 | other | Cu4I4 | 8 | 160 | 217.78 |
mp-27945 | 10.631042 | 8.928688 | 0.031995 | other | Bi1O1 | 2 | 160 | 43.26 |
mp-13456 | -4.842279 | -1.744064 | -6.706367 | other | Zn5S5 | 10 | 160 | 195.52 |
mp-1217681 | -7.079636 | -6.758677 | 7.214634 | other | Tb2Pr1 | 3 | 160 | 101.02 |
mp-570641 | -1.115899 | 0.60553 | 2.334975 | other | Si8C8 | 16 | 160 | 168.07 |
mp-556105 | -4.841281 | -1.783608 | -6.726977 | other | Zn10S10 | 20 | 160 | 405.31 |
mp-35216 | -5.911645 | -3.51343 | -1.882656 | other | Bi1Te3 | 4 | 160 | 133.81 |
mp-1216583 | -3.201993 | -3.887638 | 0.640175 | other | Tl1P3 | 4 | 160 | 95.57 |
mp-1198139 | -4.844008 | -1.790317 | -6.731504 | other | Zn18S18 | 36 | 160 | 734.98 |
mp-1225560 | 10.140515 | 8.378465 | 3.176501 | other | Er2O3 | 5 | 160 | 75.16 |
mp-7834 | -4.648654 | -0.847285 | -2.941361 | other | Ta1Se2 | 3 | 160 | 70.35 |
mp-556576 | -4.84485 | -1.783951 | -6.732762 | other | Zn8S8 | 16 | 160 | 323.99 |
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