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-753016 | 13.360713 | 13.075421 | -1.783609 | other | V3O5F1 | 9 | 1 | 105.73 |
mp-1178259 | 5.975701 | 13.050645 | -2.574488 | other | Fe4Co12O32 | 48 | 1 | 531.97 |
mp-1236378 | 7.594206 | 12.377734 | -1.210859 | other | Li1Ni9O13 | 23 | 1 | 224.75 |
mp-1276416 | 8.929138 | 12.29031 | -1.361242 | other | Mn4Sb4O16 | 24 | 1 | 312.73 |
mp-752485 | 6.695747 | 12.692831 | -2.922701 | other | Co6O7F5 | 18 | 1 | 187.35 |
mp-765586 | 12.833999 | 10.924357 | 1.73919 | other | Ti15V1O24 | 40 | 1 | 414.39 |
mp-766557 | 12.069941 | -0.748956 | 1.062434 | other | Mn10O5F15 | 30 | 1 | 376.02 |
mp-674326 | 1.260695 | 2.069852 | -5.052393 | other | K20Nb10Cl30 | 60 | 1 | 2,258.73 |
mp-1228496 | 10.479938 | 12.005295 | 2.548383 | other | Ba4Ti11O26 | 41 | 1 | 550.5 |
mp-759307 | 10.761002 | 11.813739 | 2.635481 | other | Ti6Nb12O42 | 60 | 1 | 835.83 |
mp-799431 | 9.355155 | 5.169787 | -1.164168 | other | V4O4F4 | 12 | 1 | 130.97 |
mp-675757 | 11.587465 | 7.983853 | -2.922204 | other | Ba2As6O11 | 19 | 1 | 346.5 |
mp-764882 | 7.437195 | 7.695271 | -1.741685 | other | Fe8O10F6 | 24 | 1 | 269.45 |
mp-781602 | 8.597994 | 15.194076 | -1.617619 | other | Mn8O13F3 | 24 | 1 | 248.4 |
mp-627314 | 13.330391 | 7.757558 | -1.304351 | other | Si20H20O30 | 70 | 1 | 875.85 |
mp-676519 | 12.011859 | 10.334963 | 2.512061 | other | Sr6Nb7O21 | 34 | 1 | 472.08 |
mp-705778 | 8.460818 | 14.21242 | -1.353923 | other | Mn12Ag16O32 | 60 | 1 | 763.25 |
mp-787808 | 7.611431 | 4.958191 | -1.745928 | other | Ti16N16O8 | 40 | 1 | 427.75 |
mp-771746 | -7.553272 | -0.833346 | 2.989958 | other | Cr22Ni80Mo18 | 120 | 1 | 1,370.46 |
mp-780875 | 8.618032 | 15.178633 | -1.642179 | other | Mn8O13F3 | 24 | 1 | 249.67 |
mp-779298 | 8.606629 | 15.181108 | -1.641378 | other | Mn8O13F3 | 24 | 1 | 246.85 |
mp-777881 | 12.748468 | 0.473354 | 0.26327 | other | Fe10O11F9 | 30 | 1 | 344.27 |
mp-626435 | 11.682927 | 4.175349 | -3.851275 | other | Al4H12O12 | 28 | 1 | 216.44 |
mp-752809 | 15.092304 | 12.485003 | -0.78856 | other | V6O7F5 | 18 | 1 | 204.7 |
mp-755281 | 12.391519 | 12.710191 | -0.597756 | original | V4Cr4O12 | 20 | 1 | 198.98 |
mp-1280477 | 5.769349 | 10.145407 | -1.85795 | other | Na16Fe4O20 | 40 | 1 | 513.09 |
mp-698670 | 5.677352 | 11.08875 | -0.189364 | other | Sr14Fe14O39 | 67 | 1 | 848.9 |
mp-758645 | 6.335732 | 14.132181 | -1.936554 | other | Li9Co13O28 | 50 | 1 | 460.9 |
mp-1333995 | -5.51575 | -0.728566 | -4.213298 | other | Fe12Ni18S40 | 70 | 1 | 1,033.73 |
mp-1104831 | 7.219273 | 8.695769 | -2.445735 | other | K4Pd2O8 | 14 | 1 | 259.1 |
mp-1176464 | 12.794576 | -1.113984 | 0.689695 | other | Mn12O10F14 | 36 | 1 | 423.43 |
mp-1211244 | 6.884375 | 5.908043 | -3.815482 | other | Mg3S1O9 | 13 | 1 | 266.69 |
mp-1226179 | -7.013547 | -0.935292 | 3.306437 | other | Co12Si4Ge8 | 24 | 1 | 286.4 |
mp-1048350 | 7.977852 | 10.921614 | -0.416027 | other | Zn4Cu4O8 | 16 | 1 | 195.06 |
mp-530885 | 8.505604 | 1.489154 | 1.207044 | other | Rb16Sn16F47 | 79 | 1 | 1,647.74 |
mp-676687 | -1.249845 | 2.895963 | -3.048434 | other | Rb4Ag16I20 | 40 | 1 | 1,639.33 |
mp-752784 | 12.812029 | -0.749953 | 0.267834 | other | Mn8O8F8 | 24 | 1 | 277.15 |
mp-760358 | 10.923656 | 2.822879 | 1.484833 | other | V8O2F22 | 32 | 1 | 393.71 |
mp-685403 | -4.85647 | 0.355094 | -4.797503 | other | Tl3V24S32 | 59 | 1 | 1,086.8 |
mp-676089 | -5.684984 | -1.794424 | -2.891873 | other | Fe2Co1Se4 | 7 | 1 | 115.08 |
mp-1219562 | 10.728084 | 9.258276 | -0.654611 | other | Sb8I2O11 | 21 | 1 | 435.9 |
mp-767137 | -3.584421 | -1.391391 | -5.178181 | other | Li3Sb17S27 | 47 | 1 | 1,160.43 |
mp-1225011 | 10.669146 | 8.101995 | -7.200212 | other | Fe6P6O24 | 36 | 1 | 419.26 |
mp-775389 | 5.08972 | 10.982203 | -2.374488 | other | Fe10O19F1 | 30 | 1 | 315.95 |
mp-868005 | 8.466652 | 13.503491 | -0.931023 | other | Ga8Fe8O24 | 40 | 1 | 436.14 |
mp-1173856 | 11.956573 | 10.760702 | -2.741119 | other | Na3Mo18O52 | 73 | 1 | 1,130.37 |
mp-761093 | 9.568794 | 12.943738 | -0.518255 | other | Na12Fe20O32 | 64 | 1 | 686.34 |
mp-685632 | 11.371158 | 8.766463 | 2.071334 | other | Ba7U7O24 | 38 | 1 | 674.84 |
mp-1305869 | 15.127903 | 12.563104 | -0.862951 | other | V6O8F4 | 18 | 1 | 202.02 |
mp-531409 | 10.477123 | 12.017468 | 2.489541 | other | Li14Nb16O48 | 78 | 1 | 897.98 |
mp-531459 | 12.524895 | 7.517338 | 0.527033 | other | Mg14Al28O56 | 98 | 1 | 948.34 |
mp-779344 | 12.296629 | -0.869208 | 0.94856 | other | Mn12O7F17 | 36 | 1 | 436.35 |
mp-763216 | 9.92327 | 14.967721 | -1.434855 | other | Mn6O8F4 | 18 | 1 | 195.52 |
mp-770779 | 12.39555 | 12.693069 | -0.59438 | other | V4Cr4O12 | 20 | 1 | 199 |
mp-662523 | 10.099083 | 9.276076 | -1.832985 | other | Sr6Te6O18 | 30 | 1 | 632.33 |
mp-675061 | 10.475561 | 9.886868 | 3.22658 | other | Sr24Ta8O43 | 75 | 1 | 1,241.13 |
mp-1335117 | -3.986069 | -4.139885 | -3.678097 | other | La24Yb4Se40 | 68 | 1 | 1,866.12 |
mp-804269 | 7.916591 | 4.393311 | -1.239108 | other | V6O3F15 | 24 | 1 | 322.68 |
mp-1196419 | 10.419564 | 9.682345 | 0.688481 | other | Ta6Bi14O36 | 56 | 1 | 838.96 |
mp-752503 | 10.566794 | 9.928866 | 4.000624 | other | Ce1Zr7O16 | 24 | 1 | 302.7 |
mp-530428 | 6.139335 | 11.370733 | 0.107542 | other | Sr18Ni14O42 | 74 | 1 | 957.78 |
mp-675590 | -4.741733 | -1.472461 | -5.685014 | other | Cu6Bi1S6 | 13 | 1 | 250.94 |
mp-755126 | 8.393827 | 14.657864 | -1.743539 | other | Mn6O11F1 | 18 | 1 | 180.79 |
mp-759137 | 11.816977 | -0.544295 | 1.171546 | other | Mn12O5F19 | 36 | 1 | 451.51 |
mp-1224536 | -3.891831 | -1.409626 | -5.810236 | other | In6Sn8S19 | 33 | 1 | 771.82 |
mp-800320 | 7.570828 | 4.820148 | -1.666175 | other | V4O7F5 | 16 | 1 | 206.52 |
mp-676524 | -5.936643 | -3.683347 | -1.671951 | other | Tb7Cu3Te12 | 22 | 1 | 691.61 |
mp-532016 | 12.194594 | 7.374914 | 1.004839 | other | Ca12Al14O33 | 59 | 1 | 881.63 |
mp-766452 | 9.638746 | 8.463771 | 3.00747 | other | La9Er1O15 | 25 | 1 | 410.05 |
mp-787816 | 7.619441 | 5.001465 | -1.751245 | other | Zr16N16O8 | 40 | 1 | 538.46 |
mp-1100818 | 6.544977 | 8.625537 | -2.492006 | other | Zr4Pb4O20 | 28 | 1 | 403.54 |
mp-1182529 | 8.694913 | 9.868599 | -1.284087 | other | Na4C1O4 | 9 | 1 | 151.63 |
mp-532403 | 8.199932 | 13.341365 | -1.080807 | other | Zn10Fe20O40 | 70 | 1 | 758.15 |
mp-764009 | 12.758874 | -0.169364 | 0.010491 | other | Mn6O7F5 | 18 | 1 | 202.89 |
mp-1047025 | 9.850187 | 8.681388 | -0.373121 | other | Zn6Bi12O24 | 42 | 1 | 674.02 |
mp-758803 | 5.877323 | 13.015004 | -1.502871 | other | Li6Ni10O20 | 36 | 1 | 335.73 |
mp-758784 | 11.256642 | 9.578911 | 3.486803 | other | Y1Zr4O9 | 14 | 1 | 177.76 |
mp-850285 | 9.5109 | 0.934085 | -0.366119 | other | Ni6O1F11 | 18 | 1 | 205.74 |
mp-1101047 | 7.283326 | 5.856141 | -4.009453 | other | Ti2Cd2O6 | 10 | 1 | 277.94 |
mp-754536 | 13.363745 | 0.433177 | 1.192812 | other | Fe10O9F11 | 30 | 1 | 351.04 |
mp-1045231 | 12.806668 | 10.349375 | 0.190254 | other | Ca1W4O8 | 13 | 1 | 171.63 |
mp-686673 | -5.520128 | -2.952335 | 2.108047 | other | Ba2Hf24As36 | 62 | 1 | 1,492.19 |
mp-997523 | 11.392728 | 11.271243 | -2.412174 | other | K5W15O45 | 65 | 1 | 951.78 |
mp-676683 | 1.412941 | 2.406395 | -5.311301 | other | Li20Fe10Cl40 | 70 | 1 | 1,407.99 |
mp-531661 | 10.00411 | 10.854184 | 3.2857 | other | Nd10Ti12O39 | 61 | 1 | 817.71 |
mp-1177791 | 9.812952 | 1.803382 | 0.706225 | other | Li12V6F36 | 54 | 1 | 670.56 |
mp-755181 | 13.808296 | 12.2264 | -3.364466 | other | V4O5F7 | 16 | 1 | 195.07 |
mp-849519 | 12.817036 | -1.147811 | 0.717677 | other | Mn12O10F14 | 36 | 1 | 422.72 |
mp-676050 | 8.715701 | 3.757308 | -4.514353 | other | H8N3O6 | 17 | 1 | 161.37 |
mp-1181667 | 9.057158 | 5.090632 | -4.089522 | other | H20I4O24 | 48 | 1 | 481.82 |
mp-792780 | 8.327655 | 1.092873 | 1.768238 | other | Ba10Y6F38 | 54 | 1 | 1,047.66 |
mp-760220 | 13.182728 | 12.654432 | -0.766364 | other | Ti1V15O24 | 40 | 1 | 430.57 |
mp-673602 | 7.775774 | 5.035721 | -1.725805 | other | Al8H24O24 | 56 | 1 | 419.3 |
mp-685224 | -2.880092 | -2.527925 | -5.505041 | other | Sc22Fe7S40 | 69 | 1 | 1,427.43 |
mp-755997 | 11.722656 | 0.81306 | -0.178069 | other | Fe6O7F5 | 18 | 1 | 207.23 |
mp-755430 | 10.463141 | 0.658397 | -0.698098 | other | Co6O2F10 | 18 | 1 | 209.72 |
mp-530910 | -4.009445 | -4.147169 | -3.657329 | other | La24Yb4Se40 | 68 | 1 | 1,866.12 |
mp-1311873 | 7.994241 | 17.487261 | -0.069934 | other | Li8Mn8O16 | 32 | 1 | 301.01 |
mp-758751 | 5.890584 | 13.035819 | -1.479987 | other | Li10Ni16O32 | 58 | 1 | 545.72 |
mp-1244905 | 10.233068 | 12.743143 | -1.360712 | other | Cr16Fe16O48 | 80 | 1 | 1,005.42 |
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