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-861910 | -7.810772 | -5.613917 | 5.130231 | other | Sc6Hg2 | 8 | 194 | 178.45 |
mp-696572 | -5.094052 | -2.102492 | 2.043479 | other | Ti2P2 | 4 | 194 | 75.62 |
mp-1197433 | -8.857515 | -0.266728 | 4.8094 | other | Sm10Co38 | 48 | 194 | 688.19 |
mp-1184675 | 2.873342 | -0.444607 | -1.772248 | other | Hf2H6 | 8 | 194 | 62.57 |
mp-1203997 | -9.206334 | -6.235209 | 4.540784 | other | Er26Zn116 | 142 | 194 | 2,430.48 |
mp-977426 | -7.225406 | -0.674989 | 3.791252 | other | Nb2Co6 | 8 | 194 | 94.28 |
mp-976935 | -8.796877 | -1.327088 | 2.443097 | other | Ni6Hg2 | 8 | 194 | 105.31 |
mp-985302 | -6.240654 | -7.946241 | 5.911056 | other | Ac6Pr2 | 8 | 194 | 353.34 |
mp-978927 | -7.139263 | -6.678334 | 6.917264 | other | Sm2Er6 | 8 | 194 | 253.91 |
mp-1409 | -7.929544 | -1.644408 | 2.700953 | other | Ti4Ni12 | 16 | 194 | 182.06 |
mp-1183347 | -4.604271 | -7.276039 | 3.256949 | other | Ba6H2 | 8 | 194 | 400.26 |
mp-1183351 | -4.751756 | -7.244477 | 3.660591 | other | Ba6Nd2 | 8 | 194 | 426.2 |
mp-1184171 | -7.002878 | -4.263352 | 6.404489 | other | Er2Al6 | 8 | 194 | 151.43 |
mp-975651 | -7.245111 | -6.919207 | 7.322432 | other | Pr2Tm6 | 8 | 194 | 258.97 |
mp-1077814 | -4.054549 | -2.343485 | -4.541592 | other | Cs4S2 | 6 | 194 | 243.49 |
mp-1209010 | -5.026871 | -1.234855 | 4.625844 | other | Sc4Be34 | 38 | 194 | 359.96 |
mp-19890 | -5.521428 | -1.306159 | 4.340232 | other | U4Re8 | 12 | 194 | 218.52 |
mp-2039 | -7.616698 | -1.118348 | 5.088708 | other | Sc4Mn8 | 12 | 194 | 203.54 |
mp-985547 | -6.318229 | -7.934104 | 6.046541 | other | Ac6Sm2 | 8 | 194 | 344.64 |
mp-979292 | -6.926338 | -6.84672 | 7.203838 | other | Sm2Y6 | 8 | 194 | 272.95 |
mp-1183525 | -6.069134 | -6.378439 | 5.837826 | other | Ba2Ce6 | 8 | 194 | 267.54 |
mp-1183675 | -8.249031 | -4.543046 | 2.031733 | other | Cd2Pd6 | 8 | 194 | 128.22 |
mp-1019054 | -3.83239 | -0.273032 | 2.534046 | other | Re2C4 | 6 | 194 | 58.25 |
mp-1187971 | -5.48617 | -6.981154 | 4.620107 | other | Yb6Si2 | 8 | 194 | 212.25 |
mp-1094259 | -5.724912 | -4.048247 | 4.141413 | other | Hf6Mg2 | 8 | 194 | 174.57 |
mp-10000 | -5.214569 | -2.848473 | 3.346483 | other | Hf4S2 | 6 | 194 | 115.54 |
mp-1183250 | -7.89174 | -7.12448 | 1.938466 | other | Ag6Hg2 | 8 | 194 | 146.86 |
mp-1096994 | 0.836604 | 1.354112 | 2.738986 | other | Hf2N2 | 4 | 194 | 46.07 |
mp-973685 | -7.185497 | -6.910012 | 7.272534 | original | Nd2Ho6 | 8 | 194 | 264.47 |
mp-570571 | -7.865961 | -9.306819 | 6.408615 | other | Th8Mg16 | 24 | 194 | 623.48 |
mp-1641 | -6.251645 | -3.19767 | 0.758552 | other | Cr2Sb2 | 4 | 194 | 82.34 |
mp-1184730 | -8.303178 | -1.874271 | 2.947178 | other | Hf2Ni6 | 8 | 194 | 103.06 |
mp-20868 | -6.868939 | 0.274784 | 3.746341 | other | Fe8W4 | 12 | 194 | 148.79 |
mp-30651 | -6.258492 | -6.042387 | 3.824327 | other | Mg2Ga4 | 6 | 194 | 110.22 |
mp-1192189 | 17.599363 | 9.888559 | 7.157773 | other | Mg12O12 | 24 | 194 | 223.28 |
mp-570923 | -5.455941 | -1.318045 | 4.070001 | other | Y4Re8 | 12 | 194 | 223.78 |
mp-867281 | -6.089463 | -0.865954 | 3.934357 | other | Tc6Pt2 | 8 | 194 | 115.12 |
mp-1187404 | -5.6988 | -3.100766 | -1.732854 | other | Te6Se2 | 8 | 194 | 230.18 |
mp-545512 | 9.467793 | 8.721772 | 1.960357 | other | Ca2O2 | 4 | 194 | 66.03 |
mp-1187732 | -7.744493 | -7.708371 | 2.101926 | other | V2Hg6 | 8 | 194 | 168.33 |
mp-1187553 | -5.95802 | -6.979582 | 1.699952 | other | Tl6Sn2 | 8 | 194 | 238.98 |
mp-24082 | -5.294095 | -2.169165 | 3.433548 | other | Ta2H1 | 3 | 21 | 38.83 |
mp-7925 | -5.779386 | -4.771786 | 1.342167 | other | Ho1Sb2 | 3 | 21 | 85.23 |
mp-1018159 | -5.914639 | -4.757706 | 1.441225 | other | Er1Sb2 | 3 | 21 | 84.75 |
mp-1018120 | -5.838125 | -4.834621 | 1.446242 | other | Tm1Sb2 | 3 | 21 | 84.34 |
mp-1008902 | -5.816278 | -4.92989 | 1.154372 | other | Lu1Sb2 | 3 | 21 | 89.45 |
mp-1223901 | -6.263342 | -5.688634 | 0.622388 | other | In1Bi3 | 4 | 21 | 127.29 |
mp-1223650 | -7.376225 | -7.478906 | 1.742212 | other | In1Hg3 | 4 | 21 | 114.43 |
mp-1216836 | -5.616947 | -1.42378 | 2.223402 | other | V20As11 | 31 | 21 | 432.19 |
mp-976920 | -5.420739 | -1.033469 | -4.065699 | other | Ni18S16 | 34 | 21 | 474.78 |
mp-556454 | 15.549199 | 5.693062 | 0.362034 | other | Si16O32 | 48 | 21 | 841.37 |
mp-1018127 | -5.784186 | -4.789242 | 1.422163 | other | Tb1Sb2 | 3 | 21 | 86.09 |
mp-1018158 | -5.797041 | -4.788576 | 1.347142 | other | Dy1Sb2 | 3 | 21 | 85.3 |
mp-1200685 | 15.601621 | 5.594455 | 0.307096 | other | Si16O32 | 48 | 21 | 930.82 |
mp-1018112 | -5.772317 | -4.77812 | 1.313678 | other | Y1Sb2 | 3 | 21 | 86.24 |
mp-695817 | 9.055571 | 2.070009 | 1.626335 | other | Sc1F3 | 4 | 21 | 44.06 |
mp-1080639 | -4.255257 | -4.978841 | -3.41076 | other | Ce16Se32 | 48 | 21 | 4,304.55 |
mp-1218972 | -6.740218 | -6.129096 | 1.856954 | other | Sn3Sb1 | 4 | 21 | 111.87 |
mp-638049 | 8.758684 | 5.135967 | -2.233024 | other | Si12O24 | 36 | 210 | 386.86 |
mp-558598 | 9.718097 | 5.651772 | -1.980558 | other | Si12O24 | 36 | 211 | 623.55 |
mp-1087555 | -4.299901 | -4.659425 | -3.532736 | other | Ce12Se24 | 36 | 211 | 2,270.57 |
mp-542730 | -4.80523 | 0.011151 | 2.97767 | other | V32C28 | 60 | 212 | 579.02 |
mp-496 | -4.038034 | -5.288565 | 5.572477 | other | Sr4Si8 | 12 | 212 | 280.16 |
mp-510746 | 7.567991 | 13.179646 | -1.607724 | other | Fe20O32 | 52 | 212 | 596.88 |
mp-1102647 | 6.204975 | 2.995957 | -2.815298 | other | Na4C8 | 12 | 212 | 98.75 |
mp-571066 | -6.378376 | -6.31006 | 2.068214 | other | K24Sn100 | 124 | 212 | 4,584.46 |
mp-7275 | -3.978606 | -5.382109 | 5.288571 | other | Ba4Si8 | 12 | 212 | 308.94 |
mp-685129 | -5.549781 | -1.572298 | -3.092788 | other | Co34Se40 | 74 | 2 | 1,140.86 |
mp-1173644 | -5.359973 | -2.04179 | -1.35883 | other | Nb28Te24 | 52 | 2 | 1,213.64 |
mp-1073438 | -2.166529 | -5.855329 | 7.280107 | other | Mg8Si12 | 20 | 2 | 404.18 |
mp-1188070 | -8.473842 | -5.976811 | 2.925312 | other | Zn6Sn2 | 8 | 2 | 155.85 |
mp-1214764 | 7.596797 | 7.617911 | -3.80652 | other | B4O12 | 16 | 2 | 227.41 |
mp-2506981 | 12.757028 | 12.554141 | -1.247399 | other | V8O14 | 22 | 2 | 301.43 |
mp-1074123 | -2.650064 | -5.372419 | 7.074417 | other | Mg8Si14 | 22 | 2 | 392.17 |
mp-1074307 | -2.878342 | -7.521538 | 7.562691 | other | Mg8Si6 | 14 | 2 | 262.18 |
mp-1224501 | 8.173852 | 2.104455 | -4.398522 | other | H16N16 | 32 | 2 | 313.75 |
mp-1073016 | -2.293701 | -5.601513 | 7.294908 | other | Mg4Si6 | 10 | 2 | 177.53 |
mp-995202 | 5.884304 | 2.025704 | -2.946469 | other | H2C12 | 14 | 2 | 131.19 |
mp-1080857 | -4.256493 | -4.98413 | -3.423529 | other | Ce16Se32 | 48 | 2 | 3,017.73 |
mp-1217447 | -6.16331 | -2.351766 | -0.755298 | other | Te20Rh14 | 34 | 2 | 772.15 |
mp-685088 | -1.157052 | 1.418902 | -1.811193 | other | Sc24I50 | 74 | 2 | 2,644.22 |
mp-30518 | 12.570914 | 13.285759 | -1.588954 | other | V12O22 | 34 | 2 | 340.11 |
mp-1209298 | -3.359829 | -3.811772 | 0.466685 | other | Rb2P30 | 32 | 2 | 798.93 |
mp-1404622 | 8.249916 | 1.714682 | -0.605412 | other | Bi2F10 | 12 | 2 | 226.06 |
mp-1433590 | 8.093952 | 2.504542 | -1.04328 | other | Sb2F13 | 15 | 2 | 250.66 |
mp-32813 | 12.842949 | 10.020551 | 1.981337 | other | Ti9O10 | 19 | 2 | 204.16 |
mp-757058 | 10.161985 | 0.61249 | -0.102085 | original | Mn4F14 | 18 | 2 | 242.99 |
mp-567537 | -1.196793 | 1.935414 | -2.621794 | other | Ta4I16 | 20 | 2 | 836.3 |
mp-1192827 | -5.906799 | -7.123875 | 3.763928 | other | Eu16In6 | 22 | 2 | 813.78 |
mp-1271757 | 11.885484 | 13.619922 | -2.309264 | other | V4O8 | 12 | 2 | 155.75 |
mp-556724 | 11.75751 | 12.313176 | 1.915315 | other | Ti14O26 | 40 | 2 | 422.5 |
mp-1196461 | 6.891383 | 2.473241 | -2.892653 | other | C156F84 | 240 | 2 | 2,818.17 |
mp-29263 | -0.48859 | 0.767175 | -3.743663 | other | U2Br10 | 12 | 2 | 450.12 |
mp-555597 | 12.772935 | 13.1855 | -1.237323 | other | V8O14 | 22 | 2 | 221.52 |
mp-1073799 | -2.309949 | -6.799846 | 7.666231 | other | Mg6Si6 | 12 | 2 | 224.76 |
mp-1073812 | -2.30287 | -6.897934 | 7.661395 | other | Mg6Si6 | 12 | 2 | 232.97 |
mp-1078478 | -2.809354 | -7.492969 | 7.36793 | other | Mg8Si6 | 14 | 2 | 292.64 |
mp-722729 | 1.375308 | 2.357022 | -5.332478 | other | Yb12Cl26 | 38 | 2 | 928.54 |
mp-1831269 | 8.214854 | 2.146076 | -0.763964 | other | Sb2F10 | 12 | 2 | 207.25 |
mp-684731 | -3.962518 | -0.090674 | -4.403948 | other | Ti13S24 | 37 | 2 | 711.85 |
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