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-1223904 | 9.931354 | 8.41848 | 3.089172 | other | Ho2O3 | 5 | 115 | 78.3 |
mp-1078935 | 5.674292 | 2.096757 | -2.590903 | other | B1C7 | 8 | 115 | 47.53 |
mp-1222421 | 1.874053 | 2.816306 | 0.719992 | other | Li3N2 | 5 | 115 | 58.07 |
mp-1017551 | 9.497869 | 8.647031 | -0.447556 | other | Bi2O3 | 5 | 115 | 89.48 |
mp-1224223 | -4.023478 | -1.365835 | -5.796769 | other | In11S16 | 27 | 115 | 648.73 |
mp-1219669 | 11.437283 | 8.87915 | 2.674496 | other | Pu2O3 | 5 | 115 | 80.69 |
mp-600001 | 15.598793 | 5.649126 | 0.3949 | other | Si5O10 | 15 | 115 | 306.6 |
mp-1224674 | 9.604191 | 8.489332 | 2.930278 | other | Gd2O3 | 5 | 115 | 83.09 |
mp-33154 | -1.024932 | 2.72463 | -3.152763 | other | Ag1I2 | 3 | 115 | 116.72 |
mp-1181940 | 1.396063 | 2.371071 | -5.326872 | other | Cd1Cl2 | 3 | 115 | 88.87 |
mp-632311 | -5.290908 | -2.133236 | 3.470551 | other | Ta2H1 | 3 | 115 | 38.78 |
mp-1225322 | -5.835274 | -3.705651 | -1.529797 | other | Dy4Te7 | 11 | 115 | 334.09 |
mp-1225275 | 9.97243 | 8.428418 | 3.119348 | other | Dy2O3 | 5 | 115 | 79.73 |
mp-1217673 | 9.824047 | 8.378025 | 3.020525 | other | Tb2O3 | 5 | 115 | 81.06 |
mp-1219167 | 9.719911 | 8.478494 | 3.015214 | other | Sm2O3 | 5 | 115 | 86.54 |
mp-28056 | -6.052845 | -1.49753 | 1.256548 | other | P2Rh3 | 5 | 115 | 69.51 |
mp-1216050 | 9.885821 | 8.648436 | 3.131675 | other | Y2O3 | 5 | 115 | 80.51 |
mp-570922 | 1.421515 | 2.303895 | -5.312466 | other | Mg1Cl2 | 3 | 115 | 87.64 |
mp-1217105 | 7.615959 | 9.536382 | -1.670076 | other | Ti3O8 | 11 | 115 | 137.61 |
mp-1217048 | 0.729188 | 1.265542 | 2.74068 | other | Ti8N5 | 13 | 115 | 150.76 |
mp-1225731 | -4.777479 | -1.548792 | -5.647485 | other | Cu3S2 | 5 | 115 | 71.55 |
mp-850099 | -4.534384 | -1.144572 | -5.013238 | other | Cu1S2 | 3 | 115 | 52.54 |
mp-1225508 | -4.155535 | -4.28875 | -3.669723 | other | Er2Se3 | 5 | 115 | 123.18 |
mp-568838 | -0.807757 | 2.279586 | -3.385116 | other | Hg4I7 | 11 | 115 | 595.77 |
mp-16609 | -5.881145 | -2.037849 | 5.239582 | other | Si12Os8 | 20 | 116 | 280.9 |
mp-1207561 | -6.204603 | -5.046758 | 1.492692 | other | Zr32Bi52 | 84 | 116 | 2,260.01 |
mp-510032 | -7.12046 | -1.75364 | 4.186976 | other | Ge12Os8 | 20 | 116 | 310.57 |
mp-30665 | -8.338584 | -2.936734 | 4.435649 | other | Ga68Rh40 | 108 | 116 | 1,667.59 |
mp-1203760 | -5.649137 | -1.641876 | 4.777059 | other | Si28Tc16 | 44 | 116 | 594.65 |
mp-680339 | -5.77219 | -1.481531 | 4.701201 | other | Mn16Si28 | 44 | 116 | 510.62 |
mp-561291 | 14.975355 | 5.867703 | 0.038547 | other | Si8O16 | 24 | 116 | 354.64 |
mp-1105498 | -6.221404 | -1.516038 | 4.102721 | other | Co8Si12 | 20 | 116 | 245.09 |
mp-1197234 | -4.647179 | -0.235997 | 2.715698 | other | Ir16C20 | 36 | 116 | 383.21 |
mp-541844 | -7.827138 | -2.43495 | 3.806819 | other | Ge20Ir16 | 36 | 116 | 586.23 |
mp-20191 | -6.185922 | -1.929329 | 5.278486 | other | Si12Ru8 | 20 | 116 | 275.08 |
mp-706531 | -7.490993 | -2.09935 | 4.187672 | other | Ge12Ru8 | 20 | 116 | 305.64 |
mp-1201064 | -6.640395 | -1.979081 | 3.728596 | other | Re16Ge28 | 44 | 116 | 695.91 |
mp-680677 | -7.862417 | -3.406172 | 3.035043 | other | Sn12Ru8 | 20 | 116 | 384.1 |
mp-1189780 | -4.934169 | -0.268927 | 3.148243 | other | Os8C12 | 20 | 116 | 199.18 |
mp-1227527 | 8.155235 | 8.843274 | -0.896236 | other | Bi8O14 | 22 | 117 | 346.67 |
mp-1190410 | -4.058365 | -4.196222 | -3.791735 | other | Pr8Se16 | 24 | 117 | 609.54 |
mp-637599 | 9.36358 | 8.737745 | -0.44936 | other | Bi8O12 | 20 | 117 | 350.45 |
mp-1080308 | -4.267576 | -4.969635 | -3.417084 | other | Ce8Se16 | 24 | 118 | 1,538.01 |
mp-579963 | -6.437612 | -1.469995 | 4.503793 | other | Cr44Ge76 | 120 | 118 | 1,763.52 |
mp-680383 | -6.481546 | -1.497061 | 4.376259 | other | V68Ge124 | 192 | 118 | 2,950.26 |
mp-558200 | 15.277064 | 5.777314 | 0.206515 | other | Si8O16 | 24 | 118 | 330.74 |
mp-1212680 | -8.233331 | -2.872363 | 4.509183 | other | Ga20Ir12 | 32 | 118 | 483.61 |
mp-569901 | -6.025393 | -1.188313 | 3.630047 | other | Ge92Mo52 | 144 | 118 | 2,333.97 |
mp-567968 | -5.796154 | -1.522924 | 4.766605 | other | Mn44Si76 | 120 | 118 | 1,438.84 |
mp-1181401 | -8.282101 | -2.944095 | 4.580436 | other | Ga20Ir12 | 32 | 118 | 523.44 |
mp-1077536 | -5.749728 | -5.43691 | 0.583421 | other | Zn2Sb4 | 6 | 118 | 150.69 |
mp-1097859 | -6.85756 | -1.169513 | 4.418295 | other | Mn12Ge20 | 32 | 118 | 449.97 |
mp-1207419 | -6.228142 | -5.084839 | 1.48867 | other | Zr12Bi20 | 32 | 118 | 847.57 |
mp-672326 | -8.32593 | -5.049647 | 3.797804 | other | In12Ru4 | 16 | 118 | 369.97 |
mp-574338 | -5.974809 | -6.245442 | 3.513773 | other | Cs3Ga9 | 12 | 119 | 312.83 |
mp-30589 | -9.727991 | -4.808221 | 4.306067 | other | La9Cu36 | 45 | 119 | 743.84 |
mp-1228806 | -5.444881 | -5.58765 | 0.616706 | other | Al1Sb1 | 2 | 119 | 47.27 |
mp-567752 | -5.125849 | -6.686045 | 2.089021 | other | Cs4In6 | 10 | 119 | 407.71 |
mp-542339 | -6.074066 | -6.685848 | 2.530257 | other | Cs3In9 | 12 | 119 | 431.58 |
mp-1226722 | -6.131464 | -3.405722 | -2.18965 | other | Cd1Te1 | 2 | 119 | 56.98 |
mp-1009818 | 6.164956 | 2.876331 | -2.981661 | other | C1N2 | 3 | 119 | 18.26 |
mp-1218964 | -6.526843 | -5.854638 | 1.157409 | other | Sn1Bi1 | 2 | 119 | 62.03 |
mp-2362466 | -4.739165 | -4.862854 | 0.222139 | other | Ga1As1 | 2 | 119 | 38.67 |
mp-632219 | 2.579132 | -0.379757 | -1.487964 | other | Zr1H1 | 2 | 119 | 27.07 |
mp-1101854 | -3.215527 | 1.644669 | 2.871521 | other | Li1B11 | 12 | 119 | 83.34 |
mp-32880 | -0.392206 | 1.566423 | -4.574568 | other | Cu1Br1 | 2 | 119 | 46.39 |
mp-639682 | 15.77104 | 5.567171 | 0.425047 | other | Si10O20 | 30 | 119 | 627.57 |
mp-1220609 | -6.423063 | -1.173865 | 4.171531 | other | Nb8Cr16 | 24 | 119 | 346.01 |
mp-684580 | -1.214325 | 2.810778 | -3.115946 | other | Ag1I1 | 2 | 119 | 73.28 |
mp-1077125 | 5.65041 | 2.045749 | -2.628691 | other | B1C5 | 6 | 119 | 36.11 |
mp-31493 | -6.152756 | -6.223305 | 3.704124 | other | Rb3Ga9 | 12 | 119 | 297.48 |
mp-1103120 | -3.188593 | 1.715761 | 2.839596 | other | Li1B11 | 12 | 119 | 82.67 |
mp-1198372 | -6.240433 | -5.34807 | 0.741693 | other | Nb16Bi47 | 63 | 119 | 1,881.35 |
mp-1224785 | -5.674081 | -5.478908 | 0.627947 | other | Ga1Sb1 | 2 | 119 | 48.24 |
mp-1223902 | -5.788532 | -3.47058 | -2.654819 | other | Hg1Te1 | 2 | 119 | 57.86 |
mp-972825 | 4.0893 | -0.395626 | -2.654635 | other | Si1H8 | 9 | 119 | 118.85 |
mp-1223637 | -5.782017 | -5.648113 | 0.732682 | other | In1Sb1 | 2 | 119 | 56.76 |
mp-181 | -6.151578 | -6.192722 | 3.765416 | other | K3Ga9 | 12 | 119 | 285.75 |
mp-644923 | 15.585029 | 5.665825 | 0.333976 | other | Si48O96 | 144 | 119 | 2,818.29 |
mp-600067 | 15.474994 | 5.691927 | 0.316524 | other | Si28O56 | 84 | 119 | 2,035.53 |
mp-1057216 | -3.937217 | -1.110691 | -5.549591 | other | Li1S1 | 2 | 119 | 33.51 |
mp-10004 | -5.834048 | -0.700849 | 2.674968 | other | Mo12P4 | 16 | 121 | 231.55 |
mp-1080256 | -4.2631 | -4.983253 | -3.420742 | other | Ce8Se16 | 24 | 121 | 1,665.4 |
mp-1223154 | -2.605223 | -2.606032 | -5.507377 | other | La4S7 | 11 | 121 | 268 |
mp-1180489 | 1.885576 | 2.830574 | 0.425688 | other | Li4N4 | 8 | 121 | 102.91 |
mp-33218 | -0.855514 | 2.075289 | -3.264103 | other | Cu1I4 | 5 | 121 | 176.79 |
mp-30748 | -6.457351 | -3.421865 | 3.977 | other | Zr12Ir4 | 16 | 121 | 332.85 |
mp-32829 | 2.313328 | 2.874835 | -4.3331 | other | Cu1Cl4 | 5 | 121 | 123.9 |
mp-1101633 | -3.130161 | -2.097785 | -5.016407 | other | Yb16S29 | 45 | 121 | 947.22 |
mp-30412 | -6.935103 | -6.565644 | 2.21052 | other | Pb12Au4 | 16 | 121 | 441.13 |
mp-1180520 | -3.670897 | -1.218257 | -5.592697 | other | Li4S4 | 8 | 121 | 159.53 |
mp-1215747 | -3.111475 | -2.075708 | -5.020125 | other | Yb4S7 | 11 | 121 | 232.9 |
mp-582055 | -9.00352 | -1.758122 | 2.828858 | other | La7Ni16 | 23 | 121 | 379.02 |
mp-33107 | 8.31882 | 2.776812 | -1.744932 | other | S1F4 | 5 | 121 | 87.5 |
mp-557930 | 15.388829 | 5.753362 | 0.313614 | other | Si8O16 | 24 | 121 | 345.29 |
mp-1205436 | -7.077133 | 0.728537 | 3.428463 | other | Fe12C4 | 16 | 121 | 149.27 |
mp-7945 | -5.309435 | -1.221709 | 1.97896 | other | V12S4 | 16 | 121 | 200.57 |
mp-1188413 | -6.366892 | -3.587769 | 3.970886 | other | Zr12Rh4 | 16 | 121 | 330.86 |
mp-1209828 | -5.652765 | -0.556154 | 3.216698 | other | P4W12 | 16 | 121 | 237.47 |
mp-27962 | -0.678625 | 2.370696 | -3.352278 | other | C1I4 | 5 | 121 | 219.79 |
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