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-1196857 | 5.589609 | 2.66383 | -3.235609 | other | C52 | 52 | 62 | 1,020.62 |
mp-1007976 | -4.117932 | -6.664923 | 1.442968 | other | Cs4 | 4 | 62 | 464.93 |
mp-1064227 | -5.14437 | -7.347369 | 3.83173 | other | Ca2 | 2 | 63 | 87.02 |
mp-10021 | -6.140577 | -5.619509 | 3.607067 | other | Ga2 | 2 | 63 | 36.38 |
mp-1056957 | 6.296755 | 3.823203 | -2.268532 | other | C2 | 2 | 63 | 17.18 |
mp-1009594 | -7.082755 | -6.955595 | 7.446899 | other | Pr2 | 2 | 63 | 73.9 |
mp-1097832 | 6.305232 | 3.77228 | -2.622198 | other | C2 | 2 | 63 | 26.3 |
mp-1095269 | -4.029653 | -4.897333 | 5.754815 | other | Si12 | 12 | 63 | 259.72 |
mp-2351841 | -3.788003 | -4.923773 | 5.947301 | other | Si4 | 4 | 63 | 62.23 |
mp-1096840 | -4.707976 | -7.320683 | 3.349236 | other | Ba2 | 2 | 63 | 129.78 |
mp-1059259 | -9.475652 | -4.550611 | 3.701919 | other | Cu2 | 2 | 63 | 23.99 |
mp-1204627 | -3.993168 | -4.901909 | 5.65585 | other | Si46 | 46 | 63 | 1,069.8 |
mp-1058581 | -4.703362 | -7.319064 | 3.344135 | other | Ba2 | 2 | 63 | 131 |
mp-1059289 | -6.68126 | -0.716778 | 3.945677 | other | Cr2 | 2 | 63 | 23 |
mp-64 | -6.059972 | -6.059552 | 5.721054 | other | Ce2 | 2 | 63 | 50.76 |
mp-1067880 | -6.326076 | -5.69257 | 3.842901 | other | Ga4 | 4 | 63 | 79.72 |
mp-975204 | -4.080724 | -7.014979 | 1.593741 | other | Rb2 | 2 | 63 | 190.61 |
mp-1057315 | -5.637364 | -7.383399 | 4.034994 | other | Eu2 | 2 | 63 | 82.92 |
mp-1001113 | -3.822426 | -4.90739 | 5.88728 | other | Si4 | 4 | 63 | 61.42 |
mp-44 | -5.137356 | -3.649725 | 3.655618 | other | U2 | 2 | 63 | 39.3 |
mp-1271198 | -7.595469 | 0.546955 | 4.054244 | other | Fe4 | 4 | 63 | 48.69 |
mp-975272 | -7.234512 | -7.630654 | 1.623135 | other | Hg2 | 2 | 63 | 56.76 |
mp-1096835 | -4.805202 | -7.31551 | 3.662521 | other | Ba4 | 4 | 63 | 217.49 |
mp-1009757 | -3.992973 | -1.728979 | -3.311299 | other | Se2 | 2 | 63 | 51.96 |
mp-567540 | -6.159674 | -5.624321 | 3.588235 | other | Ga20 | 20 | 63 | 365.23 |
mp-972981 | -4.05514 | -7.108805 | 1.801502 | other | K2 | 2 | 63 | 154.17 |
mp-1058623 | 6.687317 | 5.518194 | -3.675931 | other | O2 | 2 | 63 | 20.16 |
mp-683919 | 5.741461 | 2.194868 | -2.873101 | other | C140 | 140 | 63 | 1,584.15 |
mp-1008394 | 2.191225 | 2.799528 | -4.36292 | other | Cl4 | 4 | 64 | 112.68 |
mp-142 | -6.273151 | -5.710007 | 3.787633 | original | Ga4 | 4 | 64 | 76.7 |
mp-22848 | 2.203888 | 2.801089 | -4.359114 | other | Cl4 | 4 | 64 | 112.86 |
mp-1103107 | -6.032685 | -6.90389 | 3.368466 | other | Li12 | 12 | 64 | 242.57 |
mp-1078637 | -6.399867 | -5.574359 | 0.427561 | other | Bi8 | 8 | 64 | 260.4 |
mp-1546032 | -7.237402 | -7.634108 | 1.632775 | other | Hg6 | 6 | 64 | 171.24 |
mp-1187777 | 0.210188 | 4.267413 | -2.23649 | other | Xe4 | 4 | 64 | 305.18 |
mp-1079020 | -5.344388 | -5.119085 | 3.002437 | other | Ge8 | 8 | 64 | 149.56 |
mp-573579 | -4.118873 | -6.664416 | 1.442836 | other | Cs8 | 8 | 64 | 946.5 |
mp-23153 | -0.842459 | 2.252521 | -3.182589 | other | I4 | 4 | 64 | 206.87 |
mp-1184804 | -4.051607 | -7.109632 | 1.805228 | other | K8 | 8 | 64 | 612.23 |
mp-760482 | 8.185116 | 2.569172 | -1.074797 | other | F4 | 4 | 64 | 94.43 |
mp-1067285 | -5.126185 | -7.369145 | 3.870703 | other | Ca4 | 4 | 64 | 178.13 |
mp-573691 | -4.03574 | -7.117644 | 1.825155 | other | K8 | 8 | 64 | 591.76 |
mp-1120743 | -2.968991 | -5.56302 | 1.116331 | other | P4 | 4 | 64 | 343.52 |
mp-23154 | -0.291629 | 1.536542 | -4.023146 | other | Br4 | 4 | 64 | 157.37 |
mp-1079649 | -3.959707 | -4.856889 | 5.8076 | other | Si8 | 8 | 64 | 116.89 |
mp-973783 | 4.183582 | -0.255997 | -2.82676 | other | H4 | 4 | 64 | 55.78 |
mp-157 | -3.438355 | -3.809325 | 0.500436 | original | P4 | 4 | 64 | 81.83 |
mp-1987603 | -5.353325 | -4.268283 | 3.214108 | other | U16 | 16 | 64 | 886.81 |
mp-1007857 | -6.160107 | -5.560122 | 3.729216 | other | Ga4 | 4 | 64 | 71.88 |
mp-867305 | -5.753689 | -4.688951 | 3.583812 | other | Pu4 | 4 | 64 | 75.28 |
mp-158 | -4.966967 | -4.448867 | 0.050526 | other | As4 | 4 | 64 | 98.55 |
mp-579909 | 5.788113 | 2.649388 | -2.98125 | other | C8 | 8 | 65 | 83.32 |
mp-1068966 | -4.033194 | -7.091842 | 1.796708 | other | K5 | 5 | 65 | 502.28 |
mp-9924 | -5.837134 | -2.977219 | -1.815095 | other | Te2 | 2 | 65 | 70.4 |
mp-1008374 | 5.662546 | 2.267649 | -2.920206 | other | C4 | 4 | 65 | 26.04 |
mp-1224349 | -5.398276 | -5.144092 | 2.994871 | other | Ge1 | 1 | 65 | 19.61 |
mp-1217805 | -2.027141 | -7.868411 | 2.476816 | other | Ta2 | 2 | 65 | 1,135.09 |
mp-568410 | 5.8876 | 2.414083 | -2.745485 | other | C8 | 8 | 65 | 56.96 |
mp-1078845 | 5.770656 | 2.067567 | -2.339792 | other | C8 | 8 | 65 | 46.1 |
mp-1981700 | -5.102661 | -3.801644 | 3.507173 | other | U8 | 8 | 65 | 167.18 |
mp-1066989 | 4.147401 | -0.253522 | -2.829271 | other | H4 | 4 | 65 | 56.87 |
mp-1179641 | -3.158599 | -0.549446 | -4.434212 | other | S4 | 4 | 66 | 125.52 |
mp-1179639 | -3.253402 | -0.649671 | -4.327182 | other | S4 | 4 | 66 | 119.08 |
mp-624889 | 5.701083 | 2.632613 | -3.120196 | other | C8 | 8 | 67 | 68.37 |
mp-568286 | 5.576715 | 2.006728 | -2.820744 | other | C16 | 16 | 67 | 146.43 |
mp-568363 | 5.617468 | 1.9933 | -2.714211 | other | C4 | 4 | 67 | 42.99 |
mp-148 | -5.400294 | -5.101724 | 3.058962 | other | Ge4 | 4 | 69 | 77.67 |
mp-1180981 | -0.776234 | 2.316504 | -3.199847 | other | I1 | 1 | 69 | 40.55 |
mp-1181096 | -7.116304 | -7.716671 | 1.638796 | other | Hg1 | 1 | 69 | 32.84 |
mp-109 | -3.831489 | -4.894003 | 5.938063 | other | Si4 | 4 | 69 | 59.83 |
mp-937760 | 5.579391 | 2.005749 | -2.8006 | other | C4 | 4 | 69 | 37.48 |
mp-607540 | 6.540487 | 5.803587 | -3.38189 | other | O2 | 2 | 69 | 22.13 |
mp-1184687 | -7.312104 | -7.586251 | 1.640961 | other | Hg4 | 4 | 69 | 107.79 |
mp-1179414 | -6.722508 | -6.138484 | 1.88478 | other | Sn8 | 8 | 71 | 228.68 |
mp-639751 | -0.921166 | 2.459097 | -3.262027 | original | I1 | 1 | 71 | 44.81 |
mp-1056308 | -6.710159 | -6.132693 | 1.895432 | other | Sn1 | 1 | 71 | 27.87 |
mp-998864 | 0.09212 | 1.685973 | -4.127701 | other | Br1 | 1 | 71 | 31.68 |
mp-630227 | 5.818782 | 2.277255 | -2.823548 | other | C60 | 60 | 71 | 630.91 |
mp-1120813 | -0.056321 | 1.780353 | -3.896389 | other | Br32 | 32 | 70 | 2,607.46 |
mp-1063817 | -4.048831 | -7.015003 | 1.596478 | other | Rb4 | 4 | 70 | 487.61 |
mp-1018045 | -4.070943 | -7.021882 | 1.604097 | other | Rb4 | 4 | 70 | 384.72 |
mp-77 | -2.417714 | -0.229311 | -4.625842 | other | S32 | 32 | 70 | 880.39 |
mp-571261 | -5.785201 | -4.487197 | 3.88081 | other | Pu2 | 2 | 70 | 34.78 |
mp-1061054 | -5.396788 | -5.097431 | 3.041373 | other | Ge2 | 2 | 74 | 38.03 |
mp-7245 | -3.312792 | -3.712819 | 0.661321 | other | P2 | 2 | 74 | 31.63 |
mp-754514 | 5.418791 | 3.488072 | -3.64514 | other | N2 | 2 | 74 | 28.51 |
mp-1077723 | -5.586489 | -3.905974 | 3.904902 | other | Zr6 | 6 | 72 | 140.66 |
mp-1096869 | 5.770405 | 2.104557 | -2.618894 | other | C71 | 71 | 8 | 1,422.21 |
mp-734188 | 6.630056 | 5.823101 | -3.883882 | other | O12 | 12 | 92 | 201.66 |
mp-1078638 | -5.133075 | -7.343117 | 3.892397 | other | Ca8 | 8 | 92 | 333.55 |
mp-723285 | 6.394057 | 5.931906 | -3.840003 | other | O8 | 8 | 92 | 143.65 |
mp-1102442 | 6.510294 | 5.511858 | -3.586041 | other | O12 | 12 | 92 | 110.49 |
mp-137 | -5.534611 | -5.096472 | 3.480444 | other | Ge12 | 12 | 96 | 249.6 |
mp-994911 | -2.377639 | -0.106934 | -4.547503 | other | S8 | 8 | 99 | 5,791.14 |
mp-987595 | -5.887492 | -3.715911 | -1.337464 | other | La8Te16 | 24 | 100 | 775.88 |
mp-571576 | -5.885356 | -3.713367 | -1.338093 | other | La8Te16 | 24 | 100 | 775.36 |
mp-818205 | 8.711907 | 10.511175 | -3.994028 | other | V6O20 | 26 | 100 | 435.04 |
mp-1342078 | -5.884263 | -3.711823 | -1.338723 | other | La8Te16 | 24 | 100 | 775.36 |
mp-2565 | 4.989593 | 3.176102 | -4.084486 | other | S16N8 | 24 | 102 | 598.37 |
mp-1227307 | -6.992703 | -0.424956 | 3.781738 | other | Cr16Co14 | 30 | 102 | 354.67 |
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