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-1221751 | -7.317943 | -3.901965 | 2.630249 | other | Mn1Fe1Sn4 | 6 | 97 | 120.82 |
mp-38394 | -5.995934 | -3.55541 | -1.891567 | other | Ba1Al2Te4 | 7 | 97 | 254.06 |
mp-1224579 | -5.4505 | -3.415183 | 2.736346 | other | Hf10Ni1Sb5 | 16 | 97 | 336.65 |
mp-1217253 | -5.172454 | -2.722963 | 2.656785 | other | Ti10Cr1Sb5 | 16 | 97 | 288.24 |
mp-1215368 | -6.153249 | -3.582151 | 3.995973 | other | Zr4Fe1Co1 | 6 | 97 | 112.34 |
mp-1224489 | -5.428234 | -3.403897 | 2.931585 | other | Hf10V1Sb5 | 16 | 97 | 336.97 |
mp-1219291 | -5.972643 | -0.881141 | 3.359106 | other | Si5Mo10P1 | 16 | 97 | 230.03 |
mp-1224484 | -5.467341 | -3.438859 | 2.791545 | other | Hf10Mn1Sb5 | 16 | 97 | 335.47 |
mp-1215707 | -5.385771 | -3.509632 | 2.570795 | other | Zr10Cr1Sb5 | 16 | 97 | 352.23 |
mp-1220736 | -6.67529 | -6.477268 | 2.026528 | other | Na1In1Sn4 | 6 | 97 | 167.81 |
mp-1217280 | -6.322184 | -5.80927 | 5.860936 | other | Th4Si1Ge1 | 6 | 97 | 165.82 |
mp-38117 | -6.028074 | -3.569598 | -2.001286 | other | Ba1Ga2Te4 | 7 | 97 | 252.63 |
mp-33985 | -6.077227 | -3.582956 | -1.880888 | other | Ba1In2Te4 | 7 | 97 | 272.81 |
mp-1216567 | -4.678578 | -2.815083 | -3.993436 | other | Tl1In3Se4 | 8 | 97 | 236.92 |
mp-1404968 | 9.086421 | 1.003104 | -0.470217 | other | Ca1Cu2F8 | 11 | 97 | 143.97 |
mp-1102450 | 6.939283 | 5.904225 | -3.502736 | other | Sr1Au2O8 | 11 | 97 | 156.01 |
mp-1197146 | 7.123255 | 7.693204 | -3.556244 | other | Ni4S4O40 | 48 | 96 | 659.13 |
mp-1094106 | -3.887125 | -1.57025 | -5.917995 | other | Na8Zn8S12 | 28 | 96 | 626.93 |
mp-13546 | 11.784176 | 7.317929 | 0.216786 | other | Y8Ge8O28 | 44 | 96 | 576.74 |
mp-769025 | 13.078968 | 8.804277 | 4.436045 | other | K8Mg8O12 | 28 | 96 | 437.85 |
mp-1201747 | 8.591251 | 6.265433 | -5.772949 | other | Mg12S8O40 | 60 | 96 | 748.09 |
mp-771976 | 11.78013 | 6.265686 | -1.467468 | other | Rb8Be8O12 | 28 | 96 | 424.43 |
mp-774390 | 8.708083 | 13.930821 | -1.60052 | other | Mn12Sb4O32 | 48 | 96 | 616.22 |
mp-27350 | 5.255667 | -0.266427 | -2.795465 | other | U4B16H64 | 84 | 96 | 723.91 |
mp-1024051 | -4.845971 | -3.05499 | -4.034112 | other | Na8Zn8Se12 | 28 | 96 | 718.43 |
mp-680303 | 6.124878 | 5.025073 | -4.3537 | other | Hg40N40O60 | 140 | 96 | 2,298.27 |
mp-1202190 | 12.445365 | 6.587318 | 0.163809 | other | Lu8Si8O28 | 44 | 96 | 522.7 |
mp-29310 | 3.635013 | -0.55379 | -2.547574 | other | Si16H48Se8 | 72 | 96 | 1,117.29 |
mp-1229099 | 10.090238 | 7.270546 | -2.104744 | other | Al4Si8O24 | 36 | 96 | 522.08 |
mp-29816 | 8.833832 | 8.78604 | -1.439813 | other | Ag8Hg4O8 | 20 | 96 | 325.18 |
mp-752395 | 9.238549 | 8.874626 | 0.838414 | other | Ba8Na8O12 | 28 | 96 | 572.55 |
mp-558376 | 10.642007 | 11.544247 | 0.233723 | other | Na8Mn8O12 | 28 | 96 | 380.07 |
mp-29475 | 8.1085 | 0.87538 | -4.119753 | other | B12H24N12 | 48 | 96 | 529.83 |
mp-29313 | -2.524913 | -0.283396 | -5.035686 | other | Ta16P16S116 | 148 | 96 | 3,577.54 |
mp-652200 | 6.023871 | 3.443065 | -4.050818 | other | C32I16O16 | 64 | 96 | 1,436.31 |
mp-554845 | 9.733253 | 9.035372 | 0.382939 | other | Na8Zn8O12 | 28 | 96 | 354.21 |
mp-38994 | -3.606533 | -5.057483 | 6.153052 | other | Na1Al1Si4 | 6 | 99 | 112.6 |
mp-11596 | -8.197041 | -3.221152 | 2.366363 | other | Pr1B1Pt3 | 5 | 99 | 83.12 |
mp-1218060 | 0.286529 | 2.012408 | 2.342073 | other | Ta3Cr5N4 | 12 | 99 | 130.09 |
mp-1217354 | -5.712385 | -4.113805 | 0.984 | other | Th1U1Sb4 | 6 | 99 | 173.33 |
mp-1386663 | 7.705865 | 9.287858 | -1.393955 | other | Ti1Bi2O6 | 9 | 99 | 125.44 |
mp-1226980 | -7.752872 | -4.876263 | 4.811182 | other | Ce2Ga7Pd1 | 10 | 99 | 197.09 |
mp-1225561 | -7.777616 | -2.105894 | 4.984793 | other | Eu2Co5Ge3 | 10 | 99 | 165.29 |
mp-1100325 | -3.373856 | -1.617468 | -5.68378 | other | Ca1Sn1S3 | 5 | 99 | 134.33 |
mp-1217228 | -6.375364 | -2.812416 | 5.666474 | other | Ti4Al11Ni1 | 16 | 99 | 248.8 |
mp-1237836 | -7.752903 | -3.230111 | 4.279351 | other | U2Ge4Rh4 | 10 | 99 | 186.35 |
mp-1206882 | -6.989193 | -3.681506 | 3.348149 | original | La1Si1Pt3 | 5 | 99 | 93.6 |
mp-1216777 | -4.966767 | -3.678966 | 0.624191 | other | U2As3Se1 | 6 | 99 | 134.31 |
mp-1220046 | -6.300164 | -1.806366 | 0.11331 | other | Ni11Ge2Se4 | 17 | 99 | 241.01 |
mp-1218856 | -5.85102 | -5.346834 | 5.261918 | other | Sr2Al7Ge1 | 10 | 99 | 221.86 |
mp-998554 | 1.494139 | 2.665207 | -5.622878 | other | K1Ag1Cl3 | 5 | 99 | 129.5 |
mp-545522 | 8.6695 | 11.301187 | -0.448693 | other | Co1Bi1O3 | 5 | 99 | 55.77 |
mp-998420 | 1.450289 | 2.40155 | -5.449004 | other | K1Cr1Cl3 | 5 | 99 | 123.17 |
mp-1223808 | -6.548315 | -6.57414 | 2.194904 | other | In2Sn1Pb1 | 4 | 99 | 115.86 |
mp-1207210 | -7.096218 | -3.581898 | 3.229733 | other | Sm1Si1Pt3 | 5 | 99 | 90.24 |
mp-989497 | 0.822559 | 2.618874 | 1.844797 | other | La1W1N3 | 5 | 99 | 67.01 |
mp-1223239 | -6.955606 | -4.608699 | 5.976063 | other | La2Al7Cu1 | 10 | 99 | 203.26 |
mp-1239060 | 6.726615 | 6.884852 | -2.420833 | other | Li1Mn1O1 | 3 | 99 | 502.59 |
mp-1220298 | -7.037341 | -1.593807 | 1.659746 | other | Ni17Ge4Se4 | 25 | 99 | 329.7 |
mp-760376 | 7.872083 | 9.443033 | -1.211195 | other | K1Ti1O3 | 5 | 99 | 78.6 |
mp-22435 | -8.134964 | -3.28069 | 2.453494 | other | Ce1B1Pt3 | 5 | 99 | 82.21 |
mp-1224673 | -8.201221 | -6.317017 | 5.725922 | other | Ho7Cu5Sb1 | 13 | 99 | 303.96 |
mp-1217033 | -6.386658 | -3.611757 | 5.738182 | other | Ti2Al6Ge2 | 10 | 99 | 169.91 |
mp-1218049 | 0.39426 | 1.806463 | 2.525288 | other | Ta3Mo3N4 | 10 | 99 | 117.77 |
mp-1217387 | -7.702846 | -3.43714 | 4.099962 | other | U2Ge4Rh4 | 10 | 99 | 192.72 |
mp-1391774 | 8.073146 | 9.310408 | -1.490073 | other | Ti1Bi2O6 | 9 | 99 | 140.63 |
mp-1225912 | -7.75762 | -5.489635 | 3.139805 | other | Dy4Cu7Sn11 | 22 | 99 | 491.2 |
mp-2795318 | 1.123308 | 2.239039 | -5.742606 | other | Rb1Ca1Cl3 | 5 | 99 | 160.04 |
mp-1227436 | -6.86424 | -5.836899 | 4.275872 | other | Ca2Ga7Au1 | 10 | 99 | 197.25 |
mp-1223761 | -7.821225 | -5.147244 | 4.869289 | other | La2Ga7Au1 | 10 | 99 | 204.67 |
mp-1217737 | -7.76374 | -5.42924 | 3.123154 | other | Tb4Cu7Sn11 | 22 | 99 | 492.65 |
mp-1227972 | -5.848496 | -4.597132 | 0.885861 | other | Ce4Cu5Sb8 | 17 | 99 | 408.17 |
mp-998610 | 1.495265 | 2.536954 | -5.476645 | other | Tl1Ag1Cl3 | 5 | 99 | 129.28 |
mp-1222774 | 7.773957 | 11.283137 | -0.552696 | other | Li1Cu3O3 | 7 | 99 | 71.73 |
mp-1225136 | -5.79208 | -1.99463 | -2.98354 | other | Fe2Te1Se1 | 4 | 99 | 83.74 |
mp-1068742 | 10.130156 | 9.628476 | 4.013724 | other | Sr1Zr1O3 | 5 | 99 | 74.58 |
mp-1096927 | 1.166546 | 2.378608 | -5.932235 | other | Cs1Ca1Cl3 | 5 | 99 | 163.02 |
mp-1224163 | -5.894142 | -1.887364 | 5.797001 | other | Ho4Fe5Si3 | 12 | 99 | 211.71 |
mp-1227249 | -6.723897 | -3.499635 | 1.10739 | other | Ce2Sb3Rh4 | 9 | 99 | 189.52 |
mp-13108 | 9.834977 | 9.614089 | 4.091746 | other | Sr1Hf1O3 | 5 | 99 | 71.01 |
mp-998204 | 1.242447 | 2.551647 | -5.733519 | other | Rb1In1Cl3 | 5 | 99 | 162.1 |
mp-998323 | -0.48153 | 1.201702 | -4.744597 | other | Cs1In1Br3 | 5 | 99 | 192.51 |
mp-1220167 | -6.270717 | -2.165075 | 0.257874 | other | Ni11Ge2Te4 | 17 | 99 | 261.37 |
mp-1223235 | -5.878309 | -4.841746 | 0.868633 | other | La4Cu5Sb8 | 17 | 99 | 414.96 |
mp-1219873 | -7.973822 | -4.739553 | 5.195723 | other | Pr2Ga7Ni1 | 10 | 99 | 190.24 |
mp-1217218 | -7.751856 | -4.402 | 4.565593 | other | U2Ga5Cu3 | 10 | 99 | 174.28 |
mp-1225000 | -6.411805 | -2.18298 | -1.255638 | other | Fe4Te3Se1 | 8 | 99 | 171.53 |
mp-1069079 | 9.313313 | 10.833975 | -0.152194 | other | Fe2Bi2O6 | 10 | 99 | 137.35 |
mp-1215759 | -6.032845 | -4.257264 | 1.473473 | other | Zr2Cu3Sb3 | 8 | 99 | 156.39 |
mp-4342 | 10.515675 | 11.505448 | 3.25087 | original | K1Nb1O3 | 5 | 99 | 66.19 |
mp-1227997 | -5.814197 | -1.381804 | 4.17517 | other | Al1Si3W2 | 6 | 99 | 82.96 |
mp-1227069 | -5.8455 | -4.608936 | 0.888242 | other | Ce2Cu3Sb4 | 9 | 99 | 204.41 |
mp-1216884 | -5.700609 | -3.142737 | 0.848853 | other | U2Ni3As4 | 9 | 99 | 153.87 |
mp-998226 | -0.547915 | 1.242046 | -4.554529 | other | Rb1Ag1Br3 | 5 | 99 | 161.61 |
mp-998525 | 11.338502 | 10.629735 | 0.91036 | other | Ca1Tc1O3 | 5 | 99 | 61.08 |
mp-1226920 | -7.719931 | -4.363668 | 4.984722 | other | Ce2Al11Pd3 | 16 | 99 | 307.06 |
mp-1217968 | -5.071809 | -2.216616 | 3.003763 | other | Ta4Se1S1 | 6 | 99 | 110.93 |
mp-1218375 | -4.134118 | -5.185565 | 5.332652 | other | Sr2Zn5Si3 | 10 | 99 | 191.18 |
mp-1217536 | -8.007421 | -5.473921 | 3.385581 | other | Th4Cu6Sn7 | 17 | 99 | 386.28 |
mp-1225183 | -6.371242 | -2.244915 | -1.458337 | other | Fe6Te4Se2 | 12 | 99 | 246.8 |
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