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-1187236 | -5.823572 | -5.881451 | 5.589805 | other | Sr1Pa3 | 4 | 139 | 108.8 |
mp-1749 | -6.020934 | -5.345388 | 5.459739 | other | Ca1Al4 | 5 | 139 | 104.72 |
mp-973271 | -3.909436 | -7.19031 | 2.448699 | other | K3Y1 | 4 | 139 | 225.78 |
mp-12665 | -5.125723 | -1.61477 | 4.709341 | other | Be12Ag1 | 13 | 139 | 115.55 |
mp-977230 | -6.751709 | -6.390184 | 3.873096 | other | Li3Tc1 | 4 | 139 | 58.45 |
mp-980811 | -7.291509 | -0.739838 | 4.44689 | other | Tm1Mn12 | 13 | 139 | 159.15 |
mp-1063133 | -8.03159 | -5.364328 | 2.99386 | other | Ca1Pd2 | 3 | 139 | 67.63 |
mp-1077367 | -6.062048 | -5.060803 | 2.445884 | other | Ce4Bi2 | 6 | 139 | 196.6 |
mp-1104222 | -7.726427 | 1.017153 | 4.893336 | other | Y1Fe12 | 13 | 139 | 168.33 |
mp-971941 | -9.457558 | -3.94353 | 3.077198 | other | Zn3Ni1 | 4 | 139 | 50.6 |
mp-1094376 | -5.299194 | -3.016194 | 4.062141 | other | Mg1Ti3 | 4 | 139 | 71.95 |
mp-973896 | -5.486615 | -1.84823 | -2.770264 | other | Ni3I1 | 4 | 139 | 54.61 |
mp-1184178 | -7.602844 | -6.377154 | 5.865832 | other | Er3Pb1 | 4 | 139 | 111.95 |
mp-973627 | -3.945048 | -7.309004 | 2.190672 | other | K3Sr1 | 4 | 139 | 275.87 |
mp-1187322 | -6.99419 | -6.705242 | 7.036459 | other | Tb3Y1 | 4 | 139 | 129.29 |
mp-1186009 | -6.316151 | -7.285893 | 2.1502 | other | Mn1Tl3 | 4 | 139 | 103.99 |
mp-1186746 | -6.355815 | -5.41615 | 1.16654 | other | Pr1Bi3 | 4 | 139 | 125.39 |
mp-984772 | -6.602345 | -5.862904 | 5.508379 | other | Ce3Zn1 | 4 | 139 | 100.49 |
mp-974972 | -3.865391 | -7.166816 | 2.25921 | other | Rb3Hf1 | 4 | 139 | 235.05 |
mp-567842 | -5.14766 | -1.290078 | 4.730725 | other | Ta1Be12 | 13 | 139 | 112.33 |
mp-1184904 | -6.75667 | -6.393528 | 2.66829 | other | In3Ga1 | 4 | 139 | 97.37 |
mp-1187805 | -7.335747 | -6.451268 | 5.949206 | other | Y3Sn1 | 4 | 139 | 115.41 |
mp-21109 | -6.616979 | -4.940085 | 5.973379 | original | La3Al12 | 15 | 139 | 317.2 |
mp-1185124 | -6.909516 | -6.825721 | 7.164186 | original | La1Nd3 | 4 | 139 | 144.19 |
mp-1039344 | -6.771468 | -6.131938 | 1.589193 | other | Sn3Bi1 | 4 | 139 | 116.83 |
mp-1014303 | 0.187785 | 2.250102 | 2.164642 | other | Cr3N2 | 5 | 139 | 47.35 |
mp-1187386 | -4.984072 | -4.979854 | 4.460364 | other | Tb1Np3 | 4 | 139 | 96.85 |
mp-976357 | -7.902179 | -6.370465 | 6.102558 | other | Lu3Sn1 | 4 | 139 | 106.99 |
mp-979116 | -6.178017 | -6.156277 | 5.944987 | other | Th3Br1 | 4 | 139 | 120.69 |
mp-1186633 | -7.033664 | -7.016705 | 7.401399 | other | Pm1Sm3 | 4 | 139 | 136.12 |
mp-1183825 | -6.868646 | -6.550927 | 6.900771 | other | Dy3Zr1 | 4 | 139 | 115.66 |
mp-2221 | -5.81305 | -3.845874 | 3.755561 | other | Zr2Ag1 | 3 | 139 | 63.91 |
mp-974358 | -7.648451 | -1.487449 | 3.766701 | other | Ir3Ru1 | 4 | 139 | 56.41 |
mp-1187177 | 8.375563 | 1.291554 | -0.378197 | other | Sr1F3 | 4 | 139 | 51.55 |
mp-1187555 | -6.140959 | -7.18542 | 1.986526 | other | Tl3Cd1 | 4 | 139 | 113.08 |
mp-1186972 | -6.961061 | -5.419076 | 5.030756 | other | Sc3Nb1 | 4 | 139 | 88.58 |
mp-971948 | -9.394797 | -4.205011 | 3.221985 | other | Zn3Co1 | 4 | 139 | 51.08 |
mp-982930 | -7.096099 | -7.346926 | 4.339499 | other | Hf1Tl3 | 4 | 139 | 99.89 |
mp-32565 | 2.859053 | -0.414578 | -1.77406 | other | Tb4H9 | 13 | 139 | 141.06 |
mp-1183998 | -7.782135 | -2.695632 | 5.552476 | other | Ga3Tc1 | 4 | 139 | 58.15 |
mp-867780 | -6.527137 | -2.210582 | 6.329775 | other | Al3Cr1 | 4 | 139 | 58.03 |
mp-1184938 | 3.392374 | -0.56919 | -2.593643 | other | K1H3 | 4 | 139 | 54.32 |
mp-1210958 | -8.252731 | -3.348009 | 2.40539 | other | Mn7Pd9 | 16 | 139 | 216.33 |
mp-1184440 | -5.594987 | -7.382149 | 4.248178 | other | Eu3Re1 | 4 | 139 | 109.25 |
mp-1185170 | -6.77561 | -6.561465 | 6.612113 | other | La3Lu1 | 4 | 139 | 140.07 |
mp-1186822 | -5.733805 | -4.673156 | 3.565541 | other | Pu3Th1 | 4 | 139 | 103.95 |
mp-975904 | -6.491243 | -7.03377 | 3.155986 | other | Li3Cd1 | 4 | 139 | 72.5 |
mp-1187406 | -6.241557 | -5.955717 | 5.905738 | other | Th3Zn1 | 4 | 139 | 114.77 |
mp-1183515 | -5.194529 | -7.369796 | 4.169746 | other | Ca3Y1 | 4 | 139 | 158.59 |
mp-1185119 | -4.023843 | -7.088229 | 1.695152 | other | K3Rb1 | 4 | 139 | 327.23 |
mp-1187951 | -8.254591 | -0.452145 | 3.759625 | other | Zn1Co3 | 4 | 139 | 45.69 |
mp-1183080 | -6.78347 | -7.96792 | 5.284583 | other | Ac3Ag1 | 4 | 139 | 150.6 |
mp-1018104 | -5.738074 | -3.839764 | 3.858004 | other | Zr2Cd1 | 3 | 139 | 66.86 |
mp-982881 | -7.176222 | -6.965286 | 7.301378 | other | Pm1Tm3 | 4 | 139 | 124.64 |
mp-1094320 | -6.356232 | -10.807426 | 5.955925 | other | Sr1Mg3 | 4 | 139 | 113.09 |
mp-2285616 | -0.375457 | 0.566229 | -0.088285 | other | K1C2 | 3 | 139 | 71.54 |
mp-1187316 | -7.168637 | -6.583984 | 6.867629 | other | Tb3Sc1 | 4 | 139 | 120.74 |
mp-1183477 | -7.902135 | -3.660916 | 1.885103 | other | Bi1Pt3 | 4 | 139 | 73.12 |
mp-1184272 | -7.544115 | -0.518304 | 3.388501 | other | Fe3Au1 | 4 | 139 | 54.26 |
mp-1186350 | -7.798385 | -1.523279 | 3.578148 | other | Ni1Ir3 | 4 | 139 | 53.8 |
mp-1186053 | -4.845942 | -7.186429 | 3.543567 | other | Na3Nb1 | 4 | 139 | 117.69 |
mp-1186415 | -6.321398 | -1.447313 | 4.38917 | other | Pa1Tc3 | 4 | 139 | 67.32 |
mp-1218021 | 0.669636 | 1.530366 | 2.642122 | other | Ta4N3 | 7 | 139 | 83.7 |
mp-1184908 | -5.048741 | -4.099352 | 3.730204 | other | Ho1U3 | 4 | 139 | 90.94 |
mp-1187229 | -6.587537 | -6.669379 | 6.366138 | other | Sr1La3 | 4 | 139 | 161.32 |
mp-30599 | -8.337558 | -4.009508 | 3.859847 | other | Ti2Cu3 | 5 | 139 | 68.21 |
mp-1185608 | -7.021912 | -6.87129 | 7.021936 | other | La1Gd3 | 4 | 139 | 136.43 |
mp-1184704 | -9.28485 | -4.521592 | 4.245851 | other | Hf1Cu3 | 4 | 139 | 56.86 |
mp-972529 | -3.700748 | -4.30028 | 0.881556 | other | Sm1P3 | 4 | 139 | 75.06 |
mp-1186036 | -5.277096 | -7.318936 | 3.059221 | other | Na3Cu1 | 4 | 139 | 101.35 |
mp-971718 | -6.274423 | -5.611411 | 0.589277 | other | Zn1Bi3 | 4 | 139 | 116.15 |
mp-982982 | 2.860932 | -0.398526 | -1.711737 | other | Hf1H3 | 4 | 139 | 28.28 |
mp-1070103 | -8.086107 | -3.777282 | 3.174073 | other | Hf2Pt3 | 5 | 139 | 87.65 |
mp-1183087 | -6.176049 | -7.973696 | 5.807039 | other | Ac3Lu1 | 4 | 139 | 163.75 |
mp-977385 | 2.627178 | -0.067934 | -1.807099 | other | Np1H3 | 4 | 139 | 36.71 |
mp-31379 | -5.366922 | -3.461523 | 2.563493 | other | Zr4Sb2 | 6 | 139 | 136.39 |
mp-1184743 | -7.22475 | -6.861391 | 7.185818 | other | Gd1Ho3 | 4 | 139 | 126.6 |
mp-1184028 | -9.126522 | -4.298018 | 3.405527 | other | Cu3Rh1 | 4 | 139 | 48.62 |
mp-634101 | 2.640252 | 2.722746 | -3.952908 | other | H1Cl1 | 2 | 139 | 46.91 |
mp-1184425 | -6.308832 | -6.091394 | 3.267159 | other | Ga3Pb1 | 4 | 139 | 91.35 |
mp-1185771 | -8.28818 | -9.154685 | 4.499433 | other | Mg2Pd1 | 3 | 139 | 52.91 |
mp-1070580 | -7.335064 | -1.662614 | 5.073742 | other | Al3Ru2 | 5 | 139 | 67.67 |
mp-865985 | -8.248927 | -4.534593 | 2.04784 | other | Cd1Pd3 | 4 | 139 | 63.92 |
mp-1187647 | -7.700111 | -6.391984 | 6.045478 | other | Tm3Sn1 | 4 | 139 | 107.6 |
mp-976365 | -7.805224 | -6.689349 | 6.814946 | other | Nd3Au1 | 4 | 139 | 115.35 |
mp-1186066 | -5.086953 | -7.134666 | 2.927858 | other | Na3Ni1 | 4 | 139 | 95.41 |
mp-555 | -7.278906 | 0.695684 | 4.08356 | original | Fe8N1 | 9 | 139 | 100.79 |
mp-1183361 | -4.774364 | -7.388832 | 3.620721 | other | Ba3Yb1 | 4 | 139 | 237.78 |
mp-1184772 | -5.642731 | -4.045715 | 3.760412 | other | Hf3Pb1 | 4 | 139 | 88.96 |
mp-1257615 | -3.021976 | -5.18929 | 6.839734 | other | Mg4Si8 | 12 | 139 | 206.91 |
mp-865900 | -5.397992 | -3.018355 | 3.686333 | other | Ti3Tl1 | 4 | 139 | 72.68 |
mp-1183580 | -6.804154 | -6.572258 | 2.707371 | other | Cd3B1 | 4 | 139 | 74.55 |
mp-1185221 | -5.14751 | -7.438359 | 3.536559 | other | K1Eu3 | 4 | 139 | 206.11 |
mp-555211 | 15.704195 | 5.621535 | 0.4091 | other | Si16O32 | 48 | 139 | 1,031.3 |
mp-1184664 | -5.775904 | -3.714756 | 3.748896 | other | Hf3Ge1 | 4 | 139 | 81.35 |
mp-999441 | -5.703773 | -2.389286 | 3.677144 | other | Nb3Cr1 | 4 | 139 | 68.64 |
mp-977128 | -7.822284 | -1.635566 | 4.618896 | other | Na1Ru3 | 4 | 139 | 58.96 |
mp-1183872 | -6.513099 | -5.718411 | 5.516506 | other | Ce3Cu1 | 4 | 139 | 93.34 |
mp-1183256 | -6.498211 | -6.815234 | 2.184933 | other | Ag1Pb3 | 4 | 139 | 113.87 |
mp-972461 | -6.794527 | -6.642099 | 6.991988 | other | Sm3Zr1 | 4 | 139 | 121.2 |
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