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-1075387 | -2.151229 | -5.873355 | 7.440866 | other | Mg10Si12 | 22 | 1 | 406.87 |
mp-714859 | 7.435718 | 5.114207 | -1.657769 | other | Bi2O3 | 5 | 1 | 92.72 |
mp-1075456 | -2.439379 | -5.664482 | 7.291689 | other | Mg6Si8 | 14 | 1 | 261.42 |
mp-1074887 | -3.273789 | -7.903588 | 7.496849 | other | Mg14Si8 | 22 | 1 | 437.51 |
mp-678007 | -4.804685 | -5.213665 | 0.472362 | other | Sr6As8 | 14 | 1 | 409.67 |
mp-1074347 | -2.85197 | -7.440228 | 7.564609 | other | Mg16Si12 | 28 | 1 | 544.61 |
mp-1245084 | 8.852843 | 12.855037 | -1.384541 | other | Fe32O48 | 80 | 1 | 1,088.27 |
mp-1100447 | -2.613211 | -5.371407 | 7.111557 | other | Mg8Si14 | 22 | 1 | 390.57 |
mp-1351349 | 6.297172 | 9.07268 | -1.282489 | other | Bi16O32 | 48 | 1 | 784.91 |
mp-1245198 | 10.145356 | 12.197447 | -4.238811 | other | V30O75 | 105 | 1 | 2,001.69 |
mp-863766 | 11.922344 | 11.952886 | -0.138334 | other | Fe32O35 | 67 | 1 | 732.29 |
mp-1445089 | 10.213327 | 10.576535 | -3.841156 | other | Mo4O12 | 16 | 1 | 228.86 |
mp-1250310 | -2.905732 | -5.233041 | 6.875444 | other | Mg8Si14 | 22 | 1 | 373.69 |
mp-1075495 | -2.097244 | -5.935537 | 7.475435 | other | Mg10Si12 | 22 | 1 | 401.98 |
mp-1245194 | -4.664073 | -1.780484 | -6.694882 | other | Zn50S50 | 100 | 1 | 2,527.03 |
mp-1262288 | -3.171938 | -5.126436 | 6.691782 | other | Mg4Si8 | 12 | 1 | 204.43 |
mp-1245208 | 11.33723 | 12.929708 | -0.517607 | other | Cr32O48 | 80 | 1 | 918.15 |
mp-675957 | 10.037936 | 9.94708 | -0.798862 | other | Sb26O53 | 79 | 1 | 1,100.17 |
mp-1040910 | 12.002758 | 13.43121 | -2.486271 | other | V12O24 | 36 | 1 | 445.89 |
mp-1228098 | -6.924187 | -4.443855 | 5.442304 | other | Ho12Ge22 | 34 | 1 | 741.3 |
mp-682953 | -3.489993 | -4.440789 | 0.682132 | other | Sr6P8 | 14 | 1 | 368.57 |
mp-1073935 | -2.720827 | -7.234185 | 7.695684 | other | Mg12Si10 | 22 | 1 | 415.36 |
mp-1245086 | 12.81754 | 11.313266 | 1.998559 | other | Ti39O65 | 104 | 1 | 1,276.22 |
mp-1075018 | -2.143605 | -5.817171 | 7.436536 | other | Mg6Si8 | 14 | 1 | 258.57 |
mp-1075385 | -2.362025 | -5.951491 | 7.439127 | other | Mg10Si12 | 22 | 1 | 398.95 |
mp-1075658 | -2.46323 | -5.509901 | 7.086844 | other | Mg10Si18 | 28 | 1 | 537.19 |
mp-1245136 | -4.664346 | -1.806642 | -6.711649 | other | Zn50S50 | 100 | 1 | 2,378.67 |
mp-1074338 | -2.930447 | -7.475293 | 7.579218 | other | Mg8Si6 | 14 | 1 | 263.63 |
mp-1245311 | 9.045395 | 8.994555 | 1.660059 | other | Ba50O50 | 100 | 1 | 2,645.17 |
mp-1075610 | -2.82304 | -5.28602 | 6.963128 | other | Mg10Si18 | 28 | 1 | 489.88 |
mp-1073398 | -2.549751 | -5.449087 | 7.008297 | other | Mg8Si16 | 24 | 1 | 446.22 |
mp-1247873 | -3.001419 | -0.957106 | -4.837189 | other | As16S17 | 33 | 1 | 1,197.67 |
mp-1074770 | -3.655571 | -8.255907 | 7.402389 | other | Mg8Si4 | 12 | 1 | 237.19 |
mp-1074932 | -2.14322 | -5.837845 | 7.448894 | other | Mg6Si8 | 14 | 1 | 254.26 |
mp-684881 | -6.575608 | -2.927153 | 0.718945 | other | Mn27Sb26 | 53 | 1 | 1,059.5 |
mp-1074676 | -3.638837 | -8.314546 | 7.268696 | other | Mg8Si4 | 12 | 1 | 228.61 |
mp-1074146 | -2.41501 | -5.524629 | 7.139791 | other | Mg8Si14 | 22 | 1 | 415.38 |
mp-1075113 | -2.078763 | -5.891508 | 7.483521 | other | Mg6Si8 | 14 | 1 | 259.39 |
mp-1219820 | -7.495161 | -7.678514 | 1.967984 | other | Sr21Hg109 | 130 | 1 | 3,579.88 |
mp-1074518 | -2.890423 | -7.492259 | 7.546099 | other | Mg8Si6 | 14 | 1 | 275.7 |
mp-1250351 | -3.172855 | -5.135203 | 6.693453 | other | Mg4Si8 | 12 | 1 | 203.78 |
mp-1074209 | -2.570211 | -5.402254 | 7.077772 | other | Mg8Si14 | 22 | 1 | 401.43 |
mp-1245037 | 12.699074 | 7.417356 | 0.719804 | other | Al40O60 | 100 | 1 | 1,118.83 |
mp-1245075 | 2.564529 | 2.516141 | 1.294595 | other | Ga50N50 | 100 | 1 | 1,435.93 |
mp-1075240 | -2.091271 | -5.880332 | 7.472945 | other | Mg6Si8 | 14 | 1 | 257.47 |
mp-1073750 | -2.223527 | -6.727721 | 7.605551 | other | Mg12Si12 | 24 | 1 | 467.5 |
mp-1232999 | 6.599286 | 5.714808 | -3.693553 | other | Li1O8 | 9 | 1 | 112.83 |
mp-1080250 | -4.26655 | -4.929307 | -3.402937 | other | Ce4Se8 | 12 | 1 | 609.82 |
mp-1100713 | -2.982479 | -7.602562 | 7.517363 | other | Mg8Si6 | 14 | 1 | 264.74 |
mp-1244909 | 12.666348 | 7.436267 | 0.690913 | other | Al40O60 | 100 | 1 | 1,084.37 |
mp-1074798 | -3.270322 | -7.90902 | 7.528105 | other | Mg14Si8 | 22 | 1 | 434.92 |
mp-1244984 | 4.624084 | 3.306647 | -3.613468 | other | Ga50N50 | 100 | 1 | 2,252.33 |
mp-684856 | -2.880848 | -0.945828 | -4.914922 | other | As24S25 | 49 | 1 | 1,512.07 |
mp-1073363 | -2.582454 | -5.457433 | 6.932517 | other | Mg8Si16 | 24 | 1 | 467.55 |
mp-1245000 | 10.113153 | 12.198657 | -4.288849 | other | V30O75 | 105 | 1 | 2,079.54 |
mp-1423059 | 2.057889 | 2.180991 | 1.40201 | other | Sb2N2 | 4 | 1 | 77.79 |
mp-1245074 | -4.772337 | -4.840679 | 0.056446 | other | Ga50As50 | 100 | 1 | 2,381.37 |
mp-1341349 | -5.520755 | -2.951536 | -4.255419 | other | Cu9Se8 | 17 | 1 | 343.99 |
mp-1245051 | 12.82167 | 11.308465 | 1.988657 | other | Ti39O65 | 104 | 1 | 1,295.45 |
mp-1244989 | -4.696108 | -1.804322 | -6.705481 | other | Zn50S50 | 100 | 1 | 2,298.27 |
mp-1075168 | -2.137193 | -5.825291 | 7.427472 | other | Mg6Si8 | 14 | 1 | 258.09 |
mp-684626 | -2.819883 | -0.911895 | -4.908315 | other | As24S26 | 50 | 1 | 1,757.66 |
mp-1075104 | -2.128096 | -5.839415 | 7.440497 | other | Mg6Si8 | 14 | 1 | 255.88 |
mp-1074856 | -3.299477 | -7.968896 | 7.491087 | other | Mg14Si8 | 22 | 1 | 436.81 |
mp-694910 | 12.47041 | 11.527616 | 0.038445 | other | Fe35O36 | 71 | 1 | 751.11 |
mp-1073451 | -2.788403 | -5.291526 | 6.959 | other | Mg4Si8 | 12 | 1 | 205.56 |
mp-1074320 | -2.899923 | -7.44971 | 7.549912 | other | Mg8Si6 | 14 | 1 | 272.7 |
mp-1245068 | -4.589809 | -1.795771 | -6.659421 | other | Zn50S50 | 100 | 1 | 2,307.45 |
mp-1073962 | -2.647163 | -7.102731 | 7.623665 | other | Mg12Si10 | 22 | 1 | 419.93 |
mp-1178875 | 6.785247 | 6.148704 | -3.992693 | other | U1O11 | 12 | 1 | 309.16 |
mp-1245254 | 12.732892 | 7.383636 | 0.701527 | other | Al40O60 | 100 | 1 | 1,114.57 |
mp-1075302 | -2.167515 | -5.826659 | 7.422655 | other | Mg6Si8 | 14 | 1 | 264.34 |
mp-1074858 | -3.284703 | -7.887896 | 7.509709 | other | Mg14Si8 | 22 | 1 | 435.44 |
mp-1073530 | -2.59165 | -5.45951 | 6.927959 | other | Mg4Si8 | 12 | 1 | 239.72 |
mp-1074542 | -2.93289 | -7.465713 | 7.589546 | other | Mg16Si12 | 28 | 1 | 529.58 |
mp-1074009 | -3.436544 | -8.083435 | 7.360948 | other | Mg18Si10 | 28 | 1 | 561.95 |
mp-1245216 | -4.59044 | -1.791071 | -6.651827 | other | Zn50S50 | 100 | 1 | 2,286.8 |
mp-1245284 | 10.055916 | 12.17546 | -4.280792 | other | V30O75 | 105 | 1 | 1,896.88 |
mp-1075766 | -2.761292 | -5.300704 | 7.006939 | other | Mg10Si18 | 28 | 1 | 487.74 |
mp-1245264 | 11.156163 | 12.047482 | 2.85856 | other | Ta30O75 | 105 | 1 | 1,693.74 |
mp-1245220 | -4.687385 | -1.819222 | -6.740404 | other | Zn50S50 | 100 | 1 | 2,397.83 |
mp-1073665 | -2.907529 | -5.233615 | 6.88673 | other | Mg4Si8 | 12 | 1 | 208.26 |
mp-557004 | 15.644756 | 5.651359 | 0.390837 | other | Si12O24 | 36 | 1 | 668.61 |
mp-1244948 | 6.630433 | 11.189777 | -1.818519 | other | Co30O60 | 90 | 1 | 1,114.04 |
mp-1244943 | 3.228129 | 2.565916 | 0.569167 | other | B50N50 | 100 | 1 | 1,206.34 |
mp-1074466 | -2.883289 | -7.400144 | 7.400916 | other | Mg8Si6 | 14 | 1 | 285.01 |
mp-1074382 | -2.923097 | -7.449803 | 7.454232 | other | Mg8Si6 | 14 | 1 | 274.38 |
mp-1245111 | 12.658731 | 7.453653 | 0.700446 | other | Al40O60 | 100 | 1 | 1,090.12 |
mp-1073623 | -2.532099 | -5.420038 | 7.11433 | other | Mg4Si8 | 12 | 1 | 219.5 |
mp-1245295 | 2.64668 | 2.586362 | 1.169091 | other | Ga50N50 | 100 | 1 | 1,499.13 |
mp-685108 | -4.753598 | -1.658837 | -5.772357 | other | Cu9S5 | 14 | 1 | 199.14 |
mp-1244904 | 10.066937 | 12.200867 | -4.286942 | other | V30O75 | 105 | 1 | 1,888.86 |
mp-1245221 | 10.112172 | 12.15796 | -4.25295 | other | V30O75 | 105 | 1 | 1,920.12 |
mp-1245092 | 9.476235 | 11.710195 | 0.01464 | other | Li68O34 | 102 | 1 | 1,043.22 |
mp-32635 | -3.575511 | -4.994517 | 0.869771 | other | Sr24P16 | 40 | 122 | 1,222.06 |
mp-7582 | -3.620604 | -1.34374 | -5.611679 | other | Ge2S4 | 6 | 122 | 144.9 |
mp-684694 | -4.53476 | -3.769249 | -3.641105 | other | Yb16Se24 | 40 | 122 | 1,066.42 |
mp-32755 | -5.826587 | -3.871699 | -1.263057 | other | La16Te24 | 40 | 122 | 1,374.42 |
mp-1443423 | -4.710104 | 0.284114 | -4.807641 | other | V2S4 | 6 | 122 | 146.55 |
mp-32838 | -5.466817 | -3.768157 | -1.086245 | other | Ce16Te24 | 40 | 122 | 1,290.54 |
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