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-1403979 | -2.96016 | -5.727453 | 6.505492 | other | Mg6Si8 | 14 | 1 | 260.95 |
mp-1245195 | 16.95031 | 9.382645 | 7.697509 | other | Mg40O40 | 80 | 1 | 979.92 |
mp-1245298 | 9.059533 | 8.966949 | 1.666391 | other | Ba50O50 | 100 | 1 | 2,610.94 |
mp-1075115 | -2.102768 | -5.887993 | 7.435782 | other | Mg6Si8 | 14 | 1 | 262.68 |
mp-1075570 | -2.093093 | -5.90469 | 7.462847 | other | Mg10Si12 | 22 | 1 | 413.47 |
mp-1073940 | -2.637443 | -7.084665 | 7.570752 | other | Mg12Si10 | 22 | 1 | 431.99 |
mp-1245112 | 10.921376 | 9.918223 | 3.732734 | other | Hf34O68 | 102 | 1 | 1,330.07 |
mp-1245202 | 10.293443 | 9.203832 | 0.1666 | other | In40O60 | 100 | 1 | 1,482.87 |
mp-1075486 | -2.087754 | -5.895509 | 7.450974 | other | Mg10Si12 | 22 | 1 | 416.15 |
mp-1244898 | 12.701719 | 7.428463 | 0.64089 | other | Al40O60 | 100 | 1 | 1,051.19 |
mp-1075009 | -2.073815 | -5.867399 | 7.394693 | other | Mg6Si8 | 14 | 1 | 266.33 |
mp-1075616 | -2.761232 | -5.321501 | 7.018089 | other | Mg10Si18 | 28 | 1 | 490.96 |
mp-1074213 | -2.710558 | -5.305357 | 7.064317 | other | Mg8Si14 | 22 | 1 | 385.84 |
mp-1220657 | -4.016429 | -0.105419 | -3.528386 | other | Nb6S10 | 16 | 1 | 297.68 |
mp-1398291 | -2.467739 | -5.610209 | 6.96778 | other | Mg4Si8 | 12 | 1 | 226.06 |
mp-1245215 | 12.681622 | 7.803451 | 0.617142 | other | Al36O18 | 54 | 1 | 1,377.64 |
mp-1073900 | -2.61587 | -7.092086 | 7.589425 | other | Mg12Si10 | 22 | 1 | 433.94 |
mp-1245174 | 9.988279 | 12.101298 | -4.288032 | other | V30O75 | 105 | 1 | 1,736.07 |
mp-1245158 | 9.092558 | 1.105498 | 1.0831 | other | Al25F75 | 100 | 1 | 1,250.92 |
mp-1244977 | 0.855499 | 1.554761 | 2.798133 | other | Ta50N50 | 100 | 1 | 1,351.5 |
mp-1245319 | -4.667561 | -1.810333 | -6.725985 | other | Zn50S50 | 100 | 1 | 2,366.36 |
mp-1075337 | -2.068602 | -5.885978 | 7.447654 | other | Mg6Si8 | 14 | 1 | 266.35 |
mp-1074832 | -3.165712 | -7.809743 | 7.428949 | other | Mg14Si8 | 22 | 1 | 453.39 |
mp-676241 | 1.863805 | 2.711101 | -4.77995 | other | Fe2Cl6 | 8 | 1 | 244.81 |
mp-1244947 | 12.667124 | 7.44021 | 0.685865 | other | Al40O60 | 100 | 1 | 1,084.15 |
mp-1219328 | -2.40392 | -0.231605 | -4.763945 | other | Se3S21 | 24 | 1 | 688.56 |
mp-1244907 | 12.542273 | 5.742479 | -1.841961 | other | Be50O50 | 100 | 1 | 803.07 |
mp-1074044 | -3.376599 | -8.039872 | 7.411423 | other | Mg18Si10 | 28 | 1 | 556.3 |
mp-1245033 | 2.672603 | 2.617338 | 1.172658 | other | Ga50N50 | 100 | 1 | 1,538.16 |
mp-1244927 | 2.615278 | 2.552847 | 1.254933 | other | Ga50N50 | 100 | 1 | 1,473.99 |
mp-1073998 | -2.796628 | -7.131174 | 7.628688 | other | Mg12Si10 | 22 | 1 | 410.1 |
mp-1244900 | 11.906885 | 8.068329 | -0.019423 | other | Ga32O48 | 80 | 1 | 1,044.72 |
mp-1075734 | -2.858741 | -5.275357 | 6.929736 | other | Mg10Si18 | 28 | 1 | 490.73 |
mp-1245001 | 11.939539 | 11.377464 | -0.144183 | other | Fe40O40 | 80 | 1 | 1,093.82 |
mp-1173348 | 10.036981 | 9.951547 | -0.799992 | other | Sb26O53 | 79 | 1 | 1,099.09 |
mp-684678 | 9.658775 | 4.196202 | -4.012794 | other | H28O14 | 42 | 1 | 372.81 |
mp-1075731 | -2.65834 | -5.34908 | 7.079309 | other | Mg10Si18 | 28 | 1 | 493.27 |
mp-1073021 | -2.176512 | -5.783456 | 7.356467 | other | Mg8Si12 | 20 | 1 | 382.34 |
mp-684591 | 12.646185 | 7.541143 | 0.608273 | other | Al16O24 | 40 | 1 | 388.93 |
mp-776583 | 9.735164 | 12.360674 | -4.297624 | other | V18O44 | 62 | 1 | 761.69 |
mp-1073075 | -2.466835 | -5.607425 | 7.211091 | other | Mg8Si12 | 20 | 1 | 378.54 |
mp-936248 | -5.481295 | -2.952642 | -4.245322 | other | Cu9Se8 | 17 | 1 | 343.99 |
mp-780521 | 7.699837 | 10.239854 | -3.854902 | other | Cr19O48 | 67 | 1 | 892.86 |
mp-1179651 | 14.116924 | 6.566708 | -0.637289 | other | Si10O16 | 26 | 1 | 502.09 |
mp-1073720 | -2.46664 | -6.864388 | 7.686604 | other | Mg6Si6 | 12 | 1 | 219.58 |
mp-675211 | 10.825827 | 11.157516 | -2.929106 | other | W7O21 | 28 | 1 | 555.27 |
mp-1245197 | -4.677524 | -1.810963 | -6.744584 | other | Zn50S50 | 100 | 1 | 2,425.53 |
mp-643430 | -3.787127 | -1.385304 | -5.86155 | other | Al12S18 | 30 | 1 | 906.92 |
mp-1245315 | 10.087257 | 12.169869 | -4.269642 | other | V30O75 | 105 | 1 | 1,857.91 |
mp-777580 | 9.884277 | 12.745566 | -4.197398 | other | V5O12 | 17 | 1 | 196.98 |
mp-1244914 | 2.88072 | 2.364484 | 1.692143 | other | Si45N60 | 105 | 1 | 1,224.49 |
mp-1244897 | 12.265088 | 7.164745 | -6.126957 | other | P30O75 | 105 | 1 | 1,867 |
mp-1075273 | -2.193921 | -5.828475 | 7.40917 | other | Mg6Si8 | 14 | 1 | 250.93 |
mp-1244912 | 11.303388 | 12.852883 | -0.65917 | other | Cr32O48 | 80 | 1 | 942.98 |
mp-1245258 | 2.624861 | 2.570046 | 1.224004 | other | Ga50N50 | 100 | 1 | 1,496.26 |
mp-1245219 | 9.854011 | 12.08523 | -4.291332 | other | V30O75 | 105 | 1 | 1,600.2 |
mp-1255188 | -2.635858 | -5.421179 | 6.909281 | other | Mg4Si8 | 12 | 1 | 234.21 |
mp-1245082 | -4.594346 | -1.794058 | -6.652391 | other | Zn50S50 | 100 | 1 | 2,408.08 |
mp-1245268 | 11.097705 | 11.109561 | -2.811606 | other | W25O75 | 100 | 1 | 1,810.62 |
mp-1073877 | -2.778867 | -7.131125 | 7.636067 | other | Mg12Si10 | 22 | 1 | 411.82 |
mp-1212508 | -8.116297 | -10.999843 | 5.798332 | other | Mg10Mn6 | 16 | 1 | 299.75 |
mp-556319 | 15.224439 | 5.78576 | 0.130229 | other | Si4O8 | 12 | 1 | 173.32 |
mp-1245002 | 2.700531 | 2.649607 | 1.067151 | other | Ga50N50 | 100 | 1 | 1,528.26 |
mp-1016069 | 0.608017 | 3.124813 | 1.577706 | other | Cr4N8 | 12 | 1 | 159.73 |
mp-1245188 | 2.645505 | 2.62165 | 1.092004 | other | Ga50N50 | 100 | 1 | 1,549.98 |
mp-1245177 | 12.599864 | 7.148448 | -6.182978 | other | P30O75 | 105 | 1 | 1,873.31 |
mp-1073613 | -2.611055 | -5.376575 | 7.018888 | other | Mg4Si8 | 12 | 1 | 220.75 |
mp-1080350 | -4.274529 | -4.228278 | -3.382159 | other | Ce3Se6 | 9 | 1 | 263.25 |
mp-1244911 | 8.594187 | 13.109924 | -1.379218 | other | Fe32O48 | 80 | 1 | 978.37 |
mp-1075482 | -2.147111 | -5.8677 | 7.419298 | other | Mg12Si16 | 28 | 1 | 517.13 |
mp-1074327 | -2.862164 | -7.398731 | 7.620233 | other | Mg16Si12 | 28 | 1 | 531.31 |
mp-1074218 | -2.595837 | -5.394785 | 7.133186 | other | Mg8Si14 | 22 | 1 | 390.91 |
mp-684966 | 7.832945 | 8.296705 | 0.517629 | other | Tb16O26 | 42 | 1 | 641.37 |
mp-1245255 | 10.404816 | 9.069235 | 0.080928 | other | Zn40O40 | 80 | 1 | 1,085.36 |
mp-1073686 | -2.37108 | -6.641023 | 7.659762 | other | Mg6Si6 | 12 | 1 | 224.56 |
mp-1096886 | 0.713081 | 3.076376 | 1.527174 | other | Cr4N8 | 12 | 1 | 246.22 |
mp-1245191 | 12.686898 | 7.421673 | 0.723708 | other | Al40O60 | 100 | 1 | 1,128.24 |
mp-1245217 | -5.528615 | -5.611384 | 0.477106 | other | Ga50Sb50 | 100 | 1 | 2,733.11 |
mp-1244917 | 3.326603 | 2.643781 | 0.476489 | other | B50N50 | 100 | 1 | 1,297.56 |
mp-1244967 | 12.67878 | 7.434927 | 0.705019 | other | Al40O60 | 100 | 1 | 1,098.23 |
mp-1245078 | 8.717954 | 12.879853 | -1.43295 | other | Fe32O48 | 80 | 1 | 1,058.1 |
mp-1245245 | 11.663941 | 7.282366 | -6.091378 | other | P30O75 | 105 | 1 | 1,734.65 |
mp-684970 | -5.489171 | -2.983755 | -4.481627 | other | Cu19Se11 | 30 | 1 | 522.07 |
mp-1380432 | 13.046124 | 10.655909 | -0.218095 | other | W12O24 | 36 | 1 | 569.73 |
mp-1074528 | -2.861151 | -7.463942 | 7.523532 | other | Mg16Si12 | 28 | 1 | 554.99 |
mp-556880 | 15.274655 | 5.743975 | 0.172869 | other | Si4O8 | 12 | 1 | 177.7 |
mp-1074288 | -2.924194 | -7.55688 | 7.506496 | other | Mg8Si6 | 14 | 1 | 268.23 |
mp-1100467 | -2.538214 | -5.473746 | 7.008673 | other | Mg4Si8 | 12 | 1 | 232.39 |
mp-1245065 | 12.698659 | 7.41727 | 0.70314 | other | Al40O60 | 100 | 1 | 1,102.54 |
mp-1245314 | -4.766555 | -4.837593 | 0.068434 | other | Ga50As50 | 100 | 1 | 2,363.02 |
mp-1073210 | -2.32334 | -5.744668 | 7.282714 | other | Mg8Si12 | 20 | 1 | 396.81 |
mp-722960 | -3.423413 | -4.067883 | 0.741133 | other | Cd14P20 | 34 | 1 | 762.94 |
mp-645449 | -5.730561 | -2.976585 | -2.044625 | other | Te36Au24 | 60 | 1 | 1,604.08 |
mp-32633 | -4.19786 | -4.189608 | -3.683882 | other | Dy24Se44 | 68 | 1 | 1,606.36 |
mp-1245281 | 3.262729 | 2.643801 | 0.584681 | other | B50N50 | 100 | 1 | 1,246.23 |
mp-1073903 | -2.68955 | -7.233541 | 7.646592 | other | Mg12Si10 | 22 | 1 | 421.18 |
mp-1080334 | -4.269334 | -4.556285 | -3.384822 | other | Ce4Se8 | 12 | 1 | 427.42 |
mp-1245178 | 9.109067 | 9.71814 | -0.609385 | other | Sn30O60 | 90 | 1 | 1,232.87 |
mp-32554 | -1.214527 | 1.995973 | -2.514327 | other | Ta2I5 | 7 | 1 | 361.72 |
mp-1247880 | 12.615604 | 7.44839 | 0.616517 | other | Al18O27 | 45 | 1 | 477.82 |
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