material_id stringlengths 6 10 | formula_pretty stringlengths 3 24 | n_elements int64 2 8 | contains_transition_metal bool 2
classes | formation_energy_per_atom float64 -2.33 7.95 | energy_per_atom float64 -16.62 2.06 | band_gap float64 -0.87 5.03 | is_semiconductor bool 2
classes | density float64 -2.48 10.3 | volume float64 -1.19 19.9 | elements stringlengths 11 46 |
|---|---|---|---|---|---|---|---|---|---|---|
mp-1176312 | Li9Mn2Co5O16 | 4 | true | 0.310293 | 0.257449 | -0.868213 | false | 0.305997 | -0.414223 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175474 | Li9Mn2Co5O16 | 4 | true | 0.129439 | 0.209752 | 0.070175 | true | 0.317112 | -0.417464 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176275 | Li9Mn2Co5O16 | 4 | true | 0.137595 | 0.211904 | -0.235331 | false | 0.305482 | -0.414073 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176316 | Li9Mn2Co5O16 | 4 | true | 0.172634 | 0.221144 | -0.868213 | false | 0.276264 | -0.405428 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176291 | Li9Mn2Co5O16 | 4 | true | 0.174923 | 0.221748 | -0.490596 | false | 0.287753 | -0.408849 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176296 | Li9Mn2Co5O16 | 4 | true | 0.151847 | 0.215662 | -0.005321 | false | 0.277714 | -0.405862 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176310 | Li9Mn2Co5O16 | 4 | true | 0.162104 | 0.218367 | -0.246706 | false | 0.315549 | -0.41701 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176277 | Li9Mn2Co5O16 | 4 | true | 0.143491 | 0.213458 | 0.158062 | true | 0.282979 | -0.407431 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176304 | Li9Mn2Co5O16 | 4 | true | 0.167457 | 0.219779 | -0.760893 | false | 0.274898 | -0.40502 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176314 | Li9Mn2Co5O16 | 4 | true | 0.147872 | 0.214614 | 0.069092 | true | 0.288921 | -0.409195 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176318 | Li9Mn2Co5O16 | 4 | true | 0.207812 | 0.230422 | -0.868213 | false | 0.324011 | -0.419462 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176322 | Li9Mn2Co5O16 | 4 | true | 0.18289 | 0.223849 | -0.477393 | false | 0.255467 | -0.399164 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176321 | Li9Mn2Co5O16 | 4 | true | 0.199766 | 0.2283 | -0.868213 | false | 0.282834 | -0.407388 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176324 | Li9Mn2Co5O16 | 4 | true | 0.214942 | 0.232302 | -0.868213 | false | 0.284582 | -0.407908 | ['Co', 'Li', 'Mn', 'O'] |
mp-1176323 | Li9Mn2Co5O16 | 4 | true | 0.19607 | 0.227325 | -0.620937 | false | 0.290529 | -0.409671 | ['Co', 'Li', 'Mn', 'O'] |
mp-759088 | Li9Ti7Cr6O30 | 4 | false | -0.790495 | -0.225392 | -0.868213 | false | 0.017898 | 0.271932 | ['Cr', 'Li', 'O', 'Ti'] |
mp-767497 | Li9Ti7Nb5O30 | 4 | false | -1.156601 | -0.310281 | -0.868213 | false | 0.150942 | 0.380389 | ['Li', 'Nb', 'O', 'Ti'] |
mp-767490 | Li9Ti12NbO30 | 4 | false | -1.327956 | -0.320603 | -0.868213 | false | -0.022635 | 0.322694 | ['Li', 'Nb', 'O', 'Ti'] |
mp-769514 | Li9Mn12Cu3O32 | 4 | true | 0.095723 | 0.02126 | -0.868213 | false | 0.265211 | 0.408883 | ['Cu', 'Li', 'Mn', 'O'] |
mp-1223032 | Li9Nd2(PS4)5 | 4 | false | 0.792771 | 0.647195 | 0.940921 | true | -0.901429 | 3.339931 | ['Li', 'Nd', 'P', 'S'] |
mp-26035 | Li9Mn3P8O29 | 4 | true | -0.722142 | -0.022382 | 0.113509 | true | -0.718211 | 2.126144 | ['Li', 'Mn', 'O', 'P'] |
mp-584450 | Li9Co3P8O29 | 4 | true | -0.547062 | 0.059828 | 0.157114 | true | -0.667517 | 2.075292 | ['Co', 'Li', 'O', 'P'] |
mp-1176793 | Li9Mn12Ni3O32 | 4 | true | 0.013705 | -0.026499 | -0.868213 | false | 0.236747 | 0.408948 | ['Li', 'Mn', 'Ni', 'O'] |
mp-777686 | Li9Mn3(WO4)7 | 4 | true | -0.274091 | -0.224512 | -0.868213 | false | 0.925391 | 0.594636 | ['Li', 'Mn', 'O', 'W'] |
mp-778229 | Li9Cr3(WO4)7 | 4 | false | -0.261371 | -0.230252 | -0.868213 | false | 1.02116 | 0.536896 | ['Cr', 'Li', 'O', 'W'] |
mp-772992 | Li9Fe3(WO4)7 | 4 | true | -0.195663 | -0.191013 | -0.868213 | false | 0.981318 | 0.56777 | ['Fe', 'Li', 'O', 'W'] |
mp-777624 | Li9V3(WO4)7 | 4 | false | -0.298359 | -0.229466 | 0.181761 | true | 0.951992 | 0.569437 | ['Li', 'O', 'V', 'W'] |
mp-26975 | Li9Cr3P8O29 | 4 | false | -0.800514 | -0.051773 | 1.219546 | true | -0.714305 | 2.087272 | ['Cr', 'Li', 'O', 'P'] |
mp-27013 | Li9V3P8O29 | 4 | false | -0.831344 | -0.049794 | 0.540554 | true | -0.747577 | 2.138559 | ['Li', 'O', 'P', 'V'] |
mp-554093 | Li9Fe3P8O29 | 4 | true | -0.68598 | -0.000552 | 0.856961 | true | -0.706033 | 2.113105 | ['Fe', 'Li', 'O', 'P'] |
mp-560209 | Li9Al3P8O29 | 4 | false | -0.985434 | 0.004399 | 2.760144 | true | -0.791575 | 1.956542 | ['Al', 'Li', 'O', 'P'] |
mp-583985 | Li9Co3P8O29 | 4 | true | -0.561832 | 0.055933 | -0.050077 | false | -0.60247 | 1.962251 | ['Co', 'Li', 'O', 'P'] |
mp-560058 | Li9Ga3P8O29 | 4 | false | -0.77011 | 0.073932 | -0.868213 | false | -0.592505 | 2.053972 | ['Ga', 'Li', 'O', 'P'] |
mp-779010 | Li9Sn3P8O29 | 4 | false | -0.623755 | 0.095094 | -0.868213 | false | -0.507708 | 2.385621 | ['Li', 'O', 'P', 'Sn'] |
mp-776590 | Li9P8W3O29 | 4 | false | -0.671415 | -0.076438 | 1.619778 | true | -0.115106 | 2.315007 | ['Li', 'O', 'P', 'W'] |
mp-778150 | Li9Nb3P8O29 | 4 | false | -0.746847 | -0.045583 | -0.773284 | false | -0.607222 | 2.31408 | ['Li', 'Nb', 'O', 'P'] |
mp-776589 | Li9Sb3P8O29 | 4 | false | -0.623829 | 0.092953 | 1.723239 | true | -0.525899 | 2.448462 | ['Li', 'O', 'P', 'Sb'] |
mp-776035 | Li9Cu3P8O29 | 4 | false | -0.481115 | 0.13112 | -0.494049 | false | -0.64007 | 2.074139 | ['Cu', 'Li', 'O', 'P'] |
mp-585305 | Li9Bi3P8O29 | 4 | false | -0.654361 | 0.089146 | 1.963676 | true | -0.131667 | 2.543302 | ['Bi', 'Li', 'O', 'P'] |
mp-1175386 | Li9Mn2Co5O16 | 4 | true | 0.172899 | 0.221214 | -0.868213 | false | 0.276751 | -0.405574 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175397 | Li9Mn2Co5O16 | 4 | true | 0.220278 | 0.233709 | 0.120754 | true | 0.363062 | -0.430593 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175406 | Li9Mn2Co5O16 | 4 | true | 0.158362 | 0.21738 | -0.115011 | false | 0.311796 | -0.415917 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175421 | Li9Mn2Co5O16 | 4 | true | 0.153351 | 0.216059 | -0.395396 | false | 0.332852 | -0.422009 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175411 | Li9Mn2Co5O16 | 4 | true | 0.174308 | 0.221586 | -0.868213 | false | 0.312068 | -0.415996 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175403 | Li9Mn2Co5O16 | 4 | true | 0.155327 | 0.21658 | -0.437512 | false | 0.340126 | -0.424093 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175425 | Li9Mn2Co5O16 | 4 | true | 0.157178 | 0.217068 | -0.3199 | false | 0.291431 | -0.409938 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175407 | Li9Mn2Co5O16 | 4 | true | 0.157071 | 0.21704 | -0.448684 | false | 0.332369 | -0.421871 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175408 | Li9Mn2Co5O16 | 4 | true | 0.14951 | 0.215046 | -0.49256 | false | 0.306181 | -0.414277 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175387 | Li9Mn2Co5O16 | 4 | true | 0.15034 | 0.215265 | 0.174854 | true | 0.306571 | -0.414391 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175388 | Li9Mn2Co5O16 | 4 | true | 0.207097 | 0.230233 | 0.173026 | true | 0.348004 | -0.426337 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175417 | Li9Mn2Co5O16 | 4 | true | 0.156929 | 0.217002 | -0.040666 | false | 0.269067 | -0.403271 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175422 | Li9Mn2Co5O16 | 4 | true | 0.16405 | 0.21888 | -0.527904 | false | 0.279859 | -0.406502 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175424 | Li9Mn2Co5O16 | 4 | true | 0.151864 | 0.215667 | -0.509419 | false | 0.331938 | -0.421747 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175391 | Li9Mn2Co5O16 | 4 | true | 0.153306 | 0.216047 | -0.30365 | false | 0.341405 | -0.424458 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175393 | Li9Mn2Co5O16 | 4 | true | 0.139972 | 0.212531 | -0.023332 | false | 0.28318 | -0.407491 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175404 | Li9Mn2Co5O16 | 4 | true | 0.301787 | 0.255206 | 0.23173 | true | 0.284955 | -0.408019 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175533 | Li9Mn2Co5O16 | 4 | true | 0.159047 | 0.217561 | -0.454778 | false | 0.289735 | -0.409436 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175453 | Li9Mn2Co5O16 | 4 | true | 0.137546 | 0.211891 | -0.302092 | false | 0.318858 | -0.417971 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175441 | Li9Mn2Co5O16 | 4 | true | 0.138118 | 0.212041 | -0.509419 | false | 0.35544 | -0.428445 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175535 | Li9Mn2Co5O16 | 4 | true | 0.202995 | 0.229151 | -0.868213 | false | 0.330486 | -0.421329 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175544 | Li9Mn2Co5O16 | 4 | true | 0.163945 | 0.218853 | -0.167689 | false | 0.302819 | -0.413292 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175454 | Li9Mn2Co5O16 | 4 | true | 0.158727 | 0.217477 | -0.531967 | false | 0.316006 | -0.417143 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175531 | Li9Mn2Co5O16 | 4 | true | 0.184747 | 0.224339 | -0.530409 | false | 0.339263 | -0.423846 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175537 | Li9Mn2Co5O16 | 4 | true | 0.220341 | 0.233726 | -0.868213 | false | 0.268889 | -0.403218 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175561 | Li9Mn2Co5O16 | 4 | true | 0.164199 | 0.21892 | -0.745455 | false | 0.304934 | -0.413912 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175470 | Li9Mn2Co5O16 | 4 | true | 0.15944 | 0.217665 | -0.611119 | false | 0.329122 | -0.420937 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175481 | Li9Mn2Co5O16 | 4 | true | 0.161501 | 0.218208 | -0.064432 | false | 0.290065 | -0.409534 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175534 | Li9Mn2Co5O16 | 4 | true | 0.187523 | 0.225071 | -0.868213 | false | 0.347025 | -0.426059 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175432 | Li9Mn2Co5O16 | 4 | true | 0.14009 | 0.212562 | -0.47008 | false | 0.352753 | -0.427684 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175438 | Li9Mn2Co5O16 | 4 | true | 0.138481 | 0.212137 | -0.368042 | false | 0.353589 | -0.427921 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175484 | Li9Mn2Co5O16 | 4 | true | 0.152196 | 0.215754 | -0.292207 | false | 0.304924 | -0.413909 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175489 | Li9Mn2Co5O16 | 4 | true | 0.158571 | 0.217435 | -0.205403 | false | 0.303426 | -0.41347 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175494 | Li9Mn2Co5O16 | 4 | true | 0.142273 | 0.213137 | -0.015071 | false | 0.305203 | -0.413991 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175526 | Li9Mn2Co5O16 | 4 | true | 0.15591 | 0.216734 | -0.088265 | false | 0.276419 | -0.405475 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175554 | Li9Mn2Co5O16 | 4 | true | 0.169903 | 0.220424 | -0.868213 | false | 0.298608 | -0.412055 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175426 | Li9Mn2Co5O16 | 4 | true | 0.221893 | 0.234135 | 0.138562 | true | 0.35135 | -0.427287 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175550 | Li9Mn2Co5O16 | 4 | true | 0.180183 | 0.223135 | -0.868213 | false | 0.300981 | -0.412753 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175431 | Li9Mn2Co5O16 | 4 | true | 0.13937 | 0.212372 | -0.270134 | false | 0.353914 | -0.428013 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175461 | Li9Mn2Co5O16 | 4 | true | 0.149893 | 0.215147 | -0.469403 | false | 0.292855 | -0.410359 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175530 | Li9Mn2Co5O16 | 4 | true | 0.160403 | 0.217919 | -0.479289 | false | 0.332677 | -0.421959 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175553 | Li9Mn2Co5O16 | 4 | true | 0.163342 | 0.218694 | -0.629739 | false | 0.301389 | -0.412873 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175501 | Li9Mn2Co5O16 | 4 | true | 0.205649 | 0.229851 | -0.862999 | false | 0.232476 | -0.392128 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175510 | Li9Mn2Co5O16 | 4 | true | 0.157467 | 0.217144 | -0.868213 | false | 0.283136 | -0.407478 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175518 | Li9Mn2Co5O16 | 4 | true | 0.151466 | 0.215562 | -0.4346 | false | 0.339597 | -0.423941 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175532 | Li9Mn2Co5O16 | 4 | true | 0.162561 | 0.218488 | -0.57828 | false | 0.271017 | -0.403857 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175595 | Li9Mn2Co5O16 | 4 | true | 0.1722 | 0.22103 | -0.534675 | false | 0.303296 | -0.413432 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175607 | Li9Mn2Co5O16 | 4 | true | 0.16315 | 0.218643 | -0.754867 | false | 0.291309 | -0.409902 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175640 | Li9Mn2Co5O16 | 4 | true | 0.169052 | 0.2202 | -0.868213 | false | 0.315997 | -0.41714 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175563 | Li9Mn2Co5O16 | 4 | true | 0.169979 | 0.220444 | -0.868213 | false | 0.307137 | -0.414557 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175570 | Li9Mn2Co5O16 | 4 | true | 0.156983 | 0.217017 | 0.050201 | true | 0.25421 | -0.398782 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175573 | Li9Mn2Co5O16 | 4 | true | 0.197102 | 0.227597 | -0.868213 | false | 0.285757 | -0.408257 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175612 | Li9Mn2Co5O16 | 4 | true | 0.159325 | 0.217634 | -0.373255 | false | 0.304832 | -0.413883 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175614 | Li9Mn2Co5O16 | 4 | true | 0.22151 | 0.234034 | -0.868213 | false | 0.263397 | -0.401564 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175633 | Li9Mn2Co5O16 | 4 | true | 0.16589 | 0.219366 | -0.55878 | false | 0.263719 | -0.401661 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175601 | Li9Mn2Co5O16 | 4 | true | 0.156258 | 0.216825 | -0.845259 | false | 0.290939 | -0.409793 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175624 | Li9Mn2Co5O16 | 4 | true | 0.154234 | 0.216292 | -0.038567 | false | 0.281277 | -0.406924 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175629 | Li9Mn2Co5O16 | 4 | true | 0.177501 | 0.222428 | -0.567108 | false | 0.297597 | -0.411758 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175576 | Li9Mn2Co5O16 | 4 | true | 0.151387 | 0.215541 | -0.064228 | false | 0.289119 | -0.409254 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175580 | Li9Mn2Co5O16 | 4 | true | 0.153536 | 0.216108 | 0.032258 | true | 0.288164 | -0.408971 | ['Co', 'Li', 'Mn', 'O'] |
mp-1175603 | Li9Mn2Co5O16 | 4 | true | 0.157727 | 0.217213 | -0.387 | false | 0.353281 | -0.427834 | ['Co', 'Li', 'Mn', 'O'] |
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