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-1245031 | 12.795049 | 11.344153 | 1.998912 | other | Ti39O65 | 104 | 1 | 1,335.65 |
mp-1232391 | 12.109899 | 11.324971 | 2.284824 | other | Nb4O9 | 13 | 1 | 179 |
mp-530018 | -4.105764 | -0.064787 | -3.571242 | other | Ta27S50 | 77 | 1 | 1,502.39 |
mp-1245019 | 8.676311 | 13.041336 | -1.363401 | other | Fe32O48 | 80 | 1 | 1,022.28 |
mp-1074291 | -3.000412 | -7.458816 | 7.596619 | other | Mg8Si6 | 14 | 1 | 258.77 |
mp-1245055 | 12.684585 | 7.429773 | 0.642376 | other | Al40O60 | 100 | 1 | 1,052.07 |
mp-685043 | 5.22785 | 2.567545 | -3.930574 | other | B18Br18 | 36 | 1 | 952.44 |
mp-1391176 | 6.846817 | 5.976338 | -3.979419 | other | Si3O12 | 15 | 1 | 231.43 |
mp-1074844 | -3.258565 | -7.882384 | 7.541164 | other | Mg14Si8 | 22 | 1 | 428.5 |
mp-1073483 | -2.511131 | -5.471314 | 7.049981 | other | Mg4Si8 | 12 | 1 | 226.74 |
mp-1245206 | 12.570986 | 9.328133 | 2.271788 | other | Ti68O34 | 102 | 1 | 1,404.21 |
mp-1074472 | -2.920065 | -7.487679 | 7.583933 | other | Mg8Si6 | 14 | 1 | 268.89 |
mp-776135 | 9.44939 | 13.180507 | -0.99666 | other | Fe23O32 | 55 | 1 | 601.91 |
mp-1075779 | -2.78969 | -5.303458 | 6.978744 | other | Mg10Si18 | 28 | 1 | 486.74 |
mp-1245060 | 12.57905 | 5.707046 | -1.896382 | other | Be50O50 | 100 | 1 | 909.52 |
mp-1073371 | -2.51882 | -5.43434 | 7.072766 | other | Mg4Si8 | 12 | 1 | 221.76 |
mp-1244899 | -4.779877 | -4.839434 | 0.060988 | other | Ga50As50 | 100 | 1 | 2,410.39 |
mp-1244932 | 11.916171 | 8.14065 | -0.109646 | other | Ga32O48 | 80 | 1 | 1,013.75 |
mp-1245165 | 2.589411 | 2.549206 | 1.253402 | other | Ga50N50 | 100 | 1 | 1,474.19 |
mp-1074259 | -2.84387 | -7.370984 | 7.319203 | other | Mg8Si6 | 14 | 1 | 290.86 |
mp-1245263 | 2.924501 | 2.381522 | 1.714029 | other | Si45N60 | 105 | 1 | 1,164.74 |
mp-1244885 | 10.910103 | 9.939375 | 3.699342 | other | Hf34O68 | 102 | 1 | 1,343.11 |
mp-1245023 | 12.710416 | 7.404623 | 0.702622 | other | Al40O60 | 100 | 1 | 1,102.56 |
mp-1073904 | -2.619628 | -6.997768 | 7.468561 | other | Mg12Si10 | 22 | 1 | 439.09 |
mp-1075723 | -2.879498 | -5.257582 | 6.92041 | other | Mg10Si18 | 28 | 1 | 484.37 |
mp-1173504 | -4.078241 | -0.098953 | -3.659905 | other | Nb3S6 | 9 | 1 | 249.47 |
mp-1073695 | -2.313725 | -6.770542 | 7.661832 | other | Mg12Si12 | 24 | 1 | 450.21 |
mp-1245322 | 3.643866 | 2.725451 | -2.758472 | other | Sb50N50 | 100 | 1 | 3,932.55 |
mp-1073590 | -2.484848 | -5.497677 | 7.045599 | other | Mg8Si16 | 24 | 1 | 455.81 |
mp-1244983 | 11.880379 | 11.446976 | -0.186892 | other | Fe40O40 | 80 | 1 | 1,092.64 |
mp-1073396 | -2.630179 | -5.427409 | 6.909867 | other | Mg4Si8 | 12 | 1 | 234.72 |
mp-1244903 | 4.465974 | 3.405303 | -3.603121 | other | Ga50N50 | 100 | 1 | 2,268.85 |
mp-753921 | -3.58946 | -1.325081 | -5.161688 | other | Sb11S18 | 29 | 1 | 757.63 |
mp-1245291 | 9.948108 | 8.523372 | 3.203815 | other | Y40O60 | 100 | 1 | 1,589.43 |
mp-556985 | 15.601448 | 5.6429 | 0.355153 | other | Si4O8 | 12 | 1 | 204.01 |
mp-1075355 | -2.01487 | -5.979895 | 7.411237 | other | Mg6Si8 | 14 | 1 | 278.34 |
mp-556788 | 14.814612 | 5.977408 | -0.197864 | other | Si4O8 | 12 | 1 | 148 |
mp-1245229 | 2.904967 | 2.381193 | 1.721935 | other | Si45N60 | 105 | 1 | 1,167.8 |
mp-1244961 | 10.16321 | 12.145062 | -4.173813 | other | V30O75 | 105 | 1 | 1,857.2 |
mp-1075649 | -2.445559 | -5.533229 | 7.080184 | other | Mg10Si18 | 28 | 1 | 543.54 |
mp-1074792 | -3.323689 | -7.936984 | 7.472666 | other | Mg14Si8 | 22 | 1 | 428.09 |
mp-1244946 | 0.828051 | 1.549224 | 2.804848 | other | Ta50N50 | 100 | 1 | 1,285.03 |
mp-1074546 | -2.947608 | -7.431939 | 7.620228 | other | Mg16Si12 | 28 | 1 | 530.59 |
mp-1245113 | 12.654588 | 7.748441 | 0.6193 | other | Al38O21 | 59 | 1 | 1,419.4 |
mp-664137 | -3.657195 | -1.37421 | -5.608192 | other | Ge6S12 | 18 | 1 | 502.76 |
mp-1385353 | -3.151712 | -5.740641 | 6.23955 | other | Mg8Si6 | 14 | 1 | 263.63 |
mp-1245064 | 11.329717 | 12.955138 | -0.570077 | other | Cr32O48 | 80 | 1 | 950.26 |
mp-1245182 | 11.172001 | 11.10168 | -2.774365 | other | W25O75 | 100 | 1 | 1,740.62 |
mp-1245301 | 3.208539 | 2.583983 | 0.573694 | other | B50N50 | 100 | 1 | 1,247.97 |
mp-1245020 | 12.807121 | 10.568376 | -0.498481 | other | W34O68 | 102 | 1 | 1,546.49 |
mp-1245081 | 12.727962 | 7.381612 | 0.719822 | other | Al40O60 | 100 | 1 | 1,128.85 |
mp-1217322 | -5.055292 | -2.766495 | -2.588134 | other | Te3Se3 | 6 | 1 | 192.5 |
mp-1074938 | -3.278592 | -7.898823 | 7.41596 | other | Mg14Si8 | 22 | 1 | 454.2 |
mp-1400283 | -2.647876 | -5.986758 | 6.256115 | other | Mg8Si6 | 14 | 1 | 285.01 |
mp-1383199 | 8.651711 | 1.7808 | 0.521109 | other | Ti2F8 | 10 | 1 | 143.48 |
mp-1245141 | 12.79933 | 9.991419 | 2.047925 | other | Ti50O50 | 100 | 1 | 1,205.34 |
mp-1073733 | -2.610005 | -6.877909 | 7.662112 | other | Mg6Si6 | 12 | 1 | 213.95 |
mp-684958 | 6.702707 | 6.215888 | -3.919523 | other | Ta1O10 | 11 | 1 | 173.86 |
mp-1245035 | -4.695084 | -1.818887 | -6.759524 | other | Zn50S50 | 100 | 1 | 2,421.56 |
mp-1245130 | 2.715713 | 2.765887 | 0.861294 | other | Ga50N50 | 100 | 1 | 1,650.48 |
mp-1074455 | -2.956834 | -7.40834 | 7.253569 | other | Mg8Si6 | 14 | 1 | 292.11 |
mp-1075741 | -2.451631 | -5.514482 | 7.091417 | other | Mg10Si18 | 28 | 1 | 535.94 |
mp-1245308 | 10.671977 | 12.305202 | 2.089235 | other | Ti30O60 | 90 | 1 | 1,070.22 |
mp-1443809 | 7.792193 | 5.000062 | -2.025289 | other | Cr4N8 | 12 | 1 | 203.22 |
mp-1075012 | -2.074541 | -5.883979 | 7.453854 | other | Mg6Si8 | 14 | 1 | 261.21 |
mp-1245272 | 10.071013 | 12.116937 | -4.228608 | other | V30O75 | 105 | 1 | 1,800.61 |
mp-1074272 | -2.890365 | -7.486405 | 7.456565 | other | Mg8Si6 | 14 | 1 | 283.59 |
mp-1244902 | 9.425839 | 8.739058 | 1.80398 | other | Ca50O50 | 100 | 1 | 1,656.79 |
mp-1075360 | -2.097931 | -5.9388 | 7.495889 | other | Mg10Si12 | 22 | 1 | 407.4 |
mp-1075576 | -2.213163 | -5.918051 | 7.46944 | other | Mg10Si12 | 22 | 1 | 400.26 |
mp-638900 | 9.820718 | 7.127077 | -2.628938 | other | Si6O14 | 20 | 1 | 671.62 |
mp-611224 | -2.983368 | -0.631581 | -4.768691 | other | V1S2 | 3 | 1 | 135.56 |
mp-1074088 | -2.741704 | -5.340543 | 6.999289 | other | Mg8Si14 | 22 | 1 | 393.57 |
mp-556588 | 14.277087 | 6.391458 | -0.476033 | other | Si4O8 | 12 | 1 | 134.15 |
mp-1245196 | 12.750676 | 7.356042 | 0.720421 | other | Al40O60 | 100 | 1 | 1,136.67 |
mp-1073470 | -2.589596 | -5.420696 | 6.996547 | other | Mg4Si8 | 12 | 1 | 226.25 |
mp-1245176 | 12.401014 | 9.119133 | 2.486092 | other | Ti75O25 | 100 | 1 | 1,435.2 |
mp-1080317 | -4.263548 | -4.94951 | -3.418859 | other | Ce4Se8 | 12 | 1 | 776.44 |
mp-1074050 | -3.403464 | -8.060256 | 7.446612 | other | Mg18Si10 | 28 | 1 | 557.98 |
mp-1075620 | -2.74008 | -5.315999 | 7.006668 | other | Mg10Si18 | 28 | 1 | 492.91 |
mp-723352 | -3.926159 | -1.440401 | -5.559297 | other | Li22S11 | 33 | 1 | 508.28 |
mp-2215229 | 6.335045 | 13.51416 | -2.348293 | other | Co7O12 | 19 | 1 | 198.02 |
mp-1354450 | 5.38948 | 11.266276 | -2.434672 | other | Fe12O24 | 36 | 1 | 447.15 |
mp-1245326 | 2.637199 | 2.563431 | 1.215992 | other | Ga50N50 | 100 | 1 | 1,486.1 |
mp-673673 | 6.959742 | 6.719932 | -3.864559 | other | Nd2O6 | 8 | 1 | 114.79 |
mp-1245296 | -4.674685 | -1.815021 | -6.71251 | other | Zn50S50 | 100 | 1 | 2,361.33 |
mp-1245059 | 11.970904 | 12.992013 | -2.702282 | other | V34O68 | 102 | 1 | 1,365.23 |
mp-1245236 | -4.65713 | -1.80525 | -6.706542 | other | Zn50S50 | 100 | 1 | 2,393.06 |
mp-1244901 | 10.077312 | 12.076952 | -4.156488 | other | V30O75 | 105 | 1 | 1,676.8 |
mp-1245052 | 12.702803 | 7.426962 | 0.749545 | other | Al40O60 | 100 | 1 | 1,156.58 |
mp-684627 | 10.279658 | 8.650183 | 3.0183 | other | Ce13O24 | 37 | 1 | 543.12 |
mp-1245004 | -4.671916 | -1.809217 | -6.70657 | other | Zn50S50 | 100 | 1 | 2,338.31 |
mp-1074930 | -3.274744 | -7.890135 | 7.528273 | other | Mg14Si8 | 22 | 1 | 437.43 |
mp-1074283 | -2.897531 | -7.519633 | 7.538249 | other | Mg8Si6 | 14 | 1 | 272.43 |
mp-1074841 | -3.273309 | -7.886815 | 7.484164 | other | Mg14Si8 | 22 | 1 | 438.67 |
mp-674831 | -4.709297 | -1.70277 | -5.623535 | other | Cu12S6 | 18 | 1 | 299.19 |
mp-1074665 | -3.689515 | -8.285045 | 7.354047 | other | Mg8Si4 | 12 | 1 | 252.69 |
mp-1244921 | -4.65713 | -1.796162 | -6.698471 | other | Zn50S50 | 100 | 1 | 2,396.18 |
mp-1244999 | -4.746675 | -4.842266 | 0.070351 | other | Ga50As50 | 100 | 1 | 2,327.41 |
mp-705472 | -2.814548 | -0.936278 | -4.912041 | other | As24S24 | 48 | 1 | 1,614.15 |
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