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-1074833 | -3.281345 | -7.916008 | 7.48192 | other | Mg14Si8 | 22 | 1 | 440.99 |
mp-1074026 | -3.473195 | -8.163754 | 7.369587 | other | Mg18Si10 | 28 | 1 | 555.28 |
mp-988253 | -3.478664 | -1.538998 | -5.270363 | other | Al12S18 | 30 | 1 | 913.38 |
mp-1244994 | 12.761119 | 7.360014 | 0.702428 | other | Al40O60 | 100 | 1 | 1,114.3 |
mp-1075724 | -2.444134 | -5.550779 | 7.04612 | other | Mg10Si18 | 28 | 1 | 552.37 |
mp-716723 | 12.359022 | 13.482233 | -1.963343 | other | V18O34 | 52 | 1 | 549.69 |
mp-1245025 | 13.623731 | 4.356406 | -2.468524 | other | B40O60 | 100 | 1 | 1,279.81 |
mp-1364247 | 11.020733 | 11.961654 | 2.696815 | other | Nb16O40 | 56 | 1 | 828.8 |
mp-1245145 | 9.13107 | 1.083568 | 1.097824 | other | Al25F75 | 100 | 1 | 1,212.98 |
mp-1244941 | 9.660715 | 9.847878 | -0.38466 | other | Sn34O68 | 102 | 1 | 1,479.17 |
mp-685157 | 8.229416 | 2.429362 | -1.015297 | other | I2F14 | 16 | 1 | 245.53 |
mp-1245279 | 12.709332 | 7.406791 | 0.717954 | other | Al40O60 | 100 | 1 | 1,140.14 |
mp-1096951 | 0.693403 | 3.065243 | 1.558769 | other | Cr24N48 | 72 | 1 | 1,485.36 |
mp-1075608 | -2.509777 | -5.487305 | 7.063236 | other | Mg10Si18 | 28 | 1 | 532.05 |
mp-1245057 | 13.448545 | 4.413147 | -2.495274 | other | B40O60 | 100 | 1 | 1,394.5 |
mp-1244926 | 12.777523 | 9.987445 | 2.0216 | other | Ti50O50 | 100 | 1 | 1,196.02 |
mp-32868 | -4.053966 | -1.349661 | -5.420753 | other | Ag6S3 | 9 | 1 | 194.76 |
mp-1244882 | 8.207897 | 12.216489 | -1.335888 | other | Co40O40 | 80 | 1 | 1,044.24 |
mp-1344756 | -2.497724 | -5.512978 | 7.049594 | other | Mg8Si14 | 22 | 1 | 393.19 |
mp-1244986 | -4.675748 | -1.790175 | -6.708183 | other | Zn50S50 | 100 | 1 | 2,484.81 |
mp-1074927 | -3.282808 | -7.861372 | 7.454175 | other | Mg14Si8 | 22 | 1 | 445.21 |
mp-1075664 | -2.483442 | -5.521445 | 7.02644 | other | Mg10Si18 | 28 | 1 | 551.22 |
mp-1073933 | -2.697421 | -7.24929 | 7.67746 | other | Mg12Si10 | 22 | 1 | 413.74 |
mp-1074613 | -3.708819 | -8.398876 | 7.273987 | other | Mg8Si4 | 12 | 1 | 237.71 |
mp-685036 | 12.626611 | 7.527395 | 0.551844 | other | Al16O24 | 40 | 1 | 379.06 |
mp-1271978 | 9.792079 | 13.093911 | -0.809157 | other | Fe12O16 | 28 | 1 | 314.92 |
mp-1073012 | -2.085431 | -5.856914 | 7.4112 | other | Mg8Si12 | 20 | 1 | 381.74 |
mp-1074562 | -2.941803 | -7.415788 | 7.42586 | other | Mg8Si6 | 14 | 1 | 278.31 |
mp-1245089 | 8.194685 | 12.301774 | -1.312262 | other | Co40O40 | 80 | 1 | 1,022.33 |
mp-1074404 | -2.90871 | -7.414835 | 7.412433 | other | Mg8Si6 | 14 | 1 | 281.61 |
mp-1244955 | 12.554443 | 9.314812 | 2.304255 | other | Ti68O34 | 102 | 1 | 1,393.56 |
mp-635425 | 9.472274 | 1.277813 | 1.00591 | other | Al2F6 | 8 | 1 | 79.01 |
mp-1074069 | -3.422144 | -8.103421 | 7.401056 | other | Mg18Si10 | 28 | 1 | 549.8 |
mp-685031 | -4.209756 | -4.160725 | -3.718885 | other | Tb48Se90 | 138 | 1 | 3,429.32 |
mp-1214306 | -5.616483 | -7.162701 | 3.834599 | other | Ca16In6 | 22 | 1 | 740.18 |
mp-1245132 | 2.681017 | 2.621343 | 1.161436 | other | Ga50N50 | 100 | 1 | 1,506.92 |
mp-1245153 | 10.012286 | 12.144136 | -4.291973 | other | V30O75 | 105 | 1 | 1,852.71 |
mp-1245228 | 3.214248 | 2.618793 | 0.60683 | other | B50N50 | 100 | 1 | 1,218.66 |
mp-1074417 | -2.889703 | -7.553863 | 7.551145 | other | Mg8Si6 | 14 | 1 | 271.2 |
mp-1074685 | -3.667002 | -8.336048 | 7.360104 | other | Mg8Si4 | 12 | 1 | 238 |
mp-1072984 | -2.283297 | -5.678377 | 7.37724 | other | Mg8Si12 | 20 | 1 | 365.78 |
mp-1245146 | -5.540405 | -5.631921 | 0.485188 | other | Ga50Sb50 | 100 | 1 | 2,806.84 |
mp-1244944 | 12.776149 | 9.979837 | 2.011397 | other | Ti50O50 | 100 | 1 | 1,190.53 |
mp-1326565 | -3.226252 | -7.777091 | 7.382261 | other | Mg14Si8 | 22 | 1 | 437.51 |
mp-1075196 | -2.414443 | -5.665618 | 7.290024 | other | Mg6Si8 | 14 | 1 | 250.86 |
mp-1075137 | -2.138422 | -5.834451 | 7.400283 | other | Mg6Si8 | 14 | 1 | 265.66 |
mp-1245010 | 3.711984 | 2.674247 | -2.665565 | other | Sb50N50 | 100 | 1 | 4,078.45 |
mp-684726 | -3.913983 | -4.148161 | -3.577474 | other | La39Se56 | 95 | 1 | 2,636.94 |
mp-1245115 | 10.84314 | 9.117532 | 0.240478 | other | Sn40O40 | 80 | 1 | 1,786.42 |
mp-767208 | -3.587455 | -1.35428 | -5.156277 | other | Sb17S27 | 44 | 1 | 1,136.71 |
mp-1245140 | 12.40512 | 9.129881 | 2.498466 | other | Ti75O25 | 100 | 1 | 1,427.92 |
mp-1245213 | -4.655246 | -1.794797 | -6.678516 | other | Zn50S50 | 100 | 1 | 2,357.51 |
mp-1351647 | 12.852119 | 10.827358 | -0.884955 | other | Mo16O32 | 48 | 1 | 701.98 |
mp-1244866 | 2.676687 | 2.623193 | 1.134532 | other | Ga50N50 | 100 | 1 | 1,543.84 |
mp-723985 | 7.969059 | 5.160893 | -1.787179 | other | Al16O24 | 40 | 1 | 412.47 |
mp-1245173 | 12.671946 | 7.419146 | 0.710908 | other | Al40O60 | 100 | 1 | 1,111.38 |
mp-1244939 | 8.171854 | 12.333653 | -1.304263 | other | Co40O40 | 80 | 1 | 997.89 |
mp-1074597 | -2.923465 | -7.44305 | 7.553099 | other | Mg8Si6 | 14 | 1 | 270.18 |
mp-1245310 | -4.653448 | -1.796712 | -6.703497 | other | Zn50S50 | 100 | 1 | 2,431.1 |
mp-1245172 | 2.510199 | 2.470476 | 1.333287 | other | Ga50N50 | 100 | 1 | 1,435.56 |
mp-1074846 | -3.280119 | -7.906516 | 7.456766 | other | Mg14Si8 | 22 | 1 | 442.51 |
mp-1245009 | 9.497813 | 11.710631 | 0.029997 | other | Li68O34 | 102 | 1 | 1,002.07 |
mp-1244991 | 3.282877 | 2.606886 | 0.531958 | other | B50N50 | 100 | 1 | 1,182.46 |
mp-1245017 | 9.937589 | 8.527807 | 3.19797 | other | Y40O60 | 100 | 1 | 1,613.13 |
mp-1244644 | -2.737315 | -7.387697 | 7.397998 | other | Mg8Si6 | 14 | 1 | 295.3 |
mp-1075363 | -1.955206 | -6.072982 | 7.484719 | other | Mg10Si12 | 22 | 1 | 429.26 |
mp-1244936 | -4.647674 | -1.81435 | -6.706535 | other | Zn50S50 | 100 | 1 | 2,358.77 |
mp-1245222 | -4.625003 | -1.806883 | -6.702118 | other | Zn50S50 | 100 | 1 | 2,418.42 |
mp-32833 | -4.164646 | -4.197836 | -3.671981 | other | Ho24Se44 | 68 | 1 | 1,588.12 |
mp-1073809 | -2.214813 | -6.654439 | 7.504562 | other | Mg6Si6 | 12 | 1 | 240.29 |
mp-1075025 | -2.104142 | -5.901196 | 7.463739 | other | Mg6Si8 | 14 | 1 | 255.94 |
mp-1245169 | -4.65814 | -1.817659 | -6.706382 | other | Zn50S50 | 100 | 1 | 2,376.05 |
mp-1245109 | 10.326298 | 9.017982 | 0.120555 | other | Zn40O40 | 80 | 1 | 1,058.16 |
mp-1074135 | -2.561752 | -5.397699 | 7.131339 | other | Mg8Si14 | 22 | 1 | 393.19 |
mp-851576 | 7.618826 | 4.935292 | -1.39727 | other | B84O11 | 95 | 1 | 706.18 |
mp-1353031 | 12.008146 | 13.159447 | -2.630035 | other | V16O32 | 48 | 1 | 587.87 |
mp-684898 | -4.834529 | -1.659286 | -5.737176 | other | Cu18S11 | 29 | 1 | 450.97 |
mp-743752 | 11.793196 | 9.061519 | 1.439288 | other | Al4C3 | 7 | 1 | 80.56 |
mp-1245046 | 2.691547 | 2.693356 | 0.961938 | other | Ga50N50 | 100 | 1 | 1,584.16 |
mp-1182249 | 9.765272 | 13.111328 | -0.812528 | other | Fe24O32 | 56 | 1 | 636.98 |
mp-1244890 | -4.672209 | -1.797495 | -6.725334 | other | Zn50S50 | 100 | 1 | 2,502.92 |
mp-1245234 | 12.712666 | 7.401254 | 0.695446 | other | Al40O60 | 100 | 1 | 1,100.11 |
mp-1245008 | 12.717176 | 7.408486 | 0.69485 | other | Al40O60 | 100 | 1 | 1,094.5 |
mp-1074673 | -2.852573 | -7.434211 | 7.571865 | other | Mg16Si12 | 28 | 1 | 538.58 |
mp-752826 | 12.576064 | 7.491118 | 0.569503 | other | Al10O15 | 25 | 1 | 242.12 |
mp-1245282 | 9.438851 | 9.780694 | -0.482631 | other | Sn34O68 | 102 | 1 | 1,454.97 |
mp-685105 | 7.435945 | 6.182366 | -4.428772 | other | Si3O12 | 15 | 1 | 231.43 |
mp-645418 | 1.879189 | 2.733145 | -4.825758 | other | Fe2Cl6 | 8 | 1 | 213.43 |
mp-1075500 | -2.180074 | -5.879293 | 7.414603 | other | Mg10Si12 | 22 | 1 | 401.11 |
mp-1245095 | 2.655621 | 2.632208 | 1.034122 | other | Ga50N50 | 100 | 1 | 1,661.66 |
mp-1245317 | -4.657837 | -1.806592 | -6.713957 | other | Zn50S50 | 100 | 1 | 2,407.27 |
mp-1245154 | 8.675593 | 12.965556 | -1.420817 | other | Fe32O48 | 80 | 1 | 1,057.27 |
mp-1073122 | -2.193087 | -5.81092 | 7.283426 | other | Mg8Si12 | 20 | 1 | 396.77 |
mp-1244880 | 12.843768 | 10.523337 | -0.435636 | other | W34O68 | 102 | 1 | 1,623.49 |
mp-1245237 | 12.766709 | 7.362589 | 0.753943 | other | Al40O60 | 100 | 1 | 1,163.91 |
mp-1073857 | -2.292783 | -6.636361 | 7.635109 | other | Mg6Si6 | 12 | 1 | 228.66 |
mp-1245288 | 2.662916 | 2.594896 | 1.176127 | other | Ga50N50 | 100 | 1 | 1,517.61 |
mp-1075015 | -1.962318 | -6.016318 | 7.528684 | other | Mg6Si8 | 14 | 1 | 268.08 |
mp-1074934 | -2.055069 | -5.897048 | 7.463959 | other | Mg6Si8 | 14 | 1 | 265.93 |
mp-1073785 | -2.355879 | -6.835135 | 7.733692 | other | Mg6Si6 | 12 | 1 | 224.78 |
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