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{
"count": 146323,
"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-spacegroup&page=11472",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-spacegroup&page=11470",
"results": [
{
"id": "mp-754127",
"created_at": "2022-09-04T14:46:59.849179Z",
"structure_string": "Li2 Co4 P4 O16\n1.0\n5.265694 0.000000 0.000000\n1.441380 7.791206 0.000000\n0.461085 0.283979 8.758111\nLi Co P O\n2 4 4 16\ndirect\n0.882965 0.026114 0.355676 Li\n0.176191 0.448337 0.772270 Li\n0.756736 0.810621 0.902362 Co\n0.681823 0.322381 0.557192 Co\n0.305800 0.681868 0.440624 Co\n0.241257 0.202916 0.089512 Co\n0.762471 0.712893 0.570293 P\n0.764064 0.213349 0.896909 P\n0.236635 0.795883 0.102089 P\n0.237737 0.282797 0.435603 P\n0.941935 0.805288 0.466061 O\n0.989132 0.734204 0.051504 O\n0.878406 0.667518 0.731091 O\n0.746667 0.537534 0.494722 O\n0.823533 0.026708 0.838572 O\n0.484651 0.811293 0.579622 O\n0.599644 0.327149 0.771660 O\n0.603813 0.223828 0.048170 O\n0.415264 0.804000 0.954740 O\n0.371450 0.669651 0.220981 O\n0.522582 0.174460 0.438714 O\n0.152569 0.978686 0.167127 O\n0.274667 0.439047 0.534295 O\n0.156072 0.333990 0.274530 O\n0.021152 0.280857 0.910342 O\n0.035985 0.187847 0.520960 O\n",
"nsites": 26,
"nelements": 4,
"elements": [
"Li",
"Co",
"P",
"O"
],
"chemical_system": "Co-Li-O-P",
"density": 2.9092044219646347,
"density_atomic": 0.07236067306130298,
"volume": 359.3111962622729,
"volume_molar": 8.32239461744382,
"formula_full": "Li2 Co4 P4 O16",
"formula_reduced": "LiCo2(PO4)2",
"formula_anonymous": "AB2C2D8",
"energy": -190.59222804,
"energy_per_atom": -7.33047030923077,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -173.04822804,
"band_gap": 0.6136999999999999,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 13.9999004,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:47.662000Z",
"spacegroup": 1
},
{
"id": "mp-760187",
"created_at": "2022-09-04T14:46:59.900056Z",
"structure_string": "Li4 V4 Cr4 P8 O32 F8\n1.0\n-5.164604 0.000000 0.000000\n2.028325 7.042937 0.000000\n-0.152587 -1.266859 -19.466139\nLi V Cr P O F\n4 4 4 8 32 8\ndirect\n0.966366 0.709219 0.109163 Li\n0.716516 0.460154 0.358552 Li\n0.467928 0.211588 0.608246 Li\n0.031056 0.288864 0.889702 Li\n0.000128 0.999791 0.999696 V\n0.750350 0.755598 0.251127 V\n0.500743 0.505707 0.501046 V\n0.250633 0.249872 0.749585 V\n0.870298 0.872005 0.625286 Cr\n0.631239 0.628717 0.873905 Cr\n0.369737 0.371951 0.125150 Cr\n0.121618 0.122837 0.375220 Cr\n0.910766 0.228440 0.528350 P\n0.844668 0.519987 0.719887 P\n0.590124 0.274545 0.972225 P\n0.343924 0.022902 0.220834 P\n0.656286 0.980632 0.779865 P\n0.410680 0.725908 0.027527 P\n0.160141 0.478351 0.278381 P\n0.093843 0.772787 0.470807 P\n0.945012 0.098936 0.805038 O\n0.890928 0.151994 0.453643 O\n0.768057 0.082971 0.579857 O\n0.988312 0.627090 0.286523 O\n0.755641 0.121255 0.965884 O\n0.971935 0.669042 0.670000 O\n0.851981 0.594831 0.794881 O\n0.738815 0.377170 0.536482 O\n0.733744 0.415740 0.919747 O\n0.804644 0.652362 0.446551 O\n0.611316 0.360417 0.045899 O\n0.477057 0.124676 0.784894 O\n0.472343 0.167592 0.169293 O\n0.555672 0.401361 0.695260 O\n0.708068 0.823924 0.050920 O\n0.353446 0.106369 0.294465 O\n0.650171 0.905833 0.705296 O\n0.292439 0.176189 0.949451 O\n0.457428 0.574345 0.301637 O\n0.528749 0.831280 0.830220 O\n0.516825 0.873652 0.217288 O\n0.390646 0.640766 0.954176 O\n0.208026 0.324381 0.551604 O\n0.266782 0.584142 0.080338 O\n0.266906 0.623538 0.467212 O\n0.139389 0.401239 0.203706 O\n0.017783 0.333169 0.330000 O\n0.244032 0.878362 0.034614 O\n0.023122 0.375316 0.715484 O\n0.222662 0.917821 0.419464 O\n0.102256 0.855477 0.544545 O\n0.054652 0.902282 0.196626 O\n0.937499 0.819859 0.920890 F\n0.685294 0.569981 0.168848 F\n0.814358 0.932675 0.330134 F\n0.437277 0.319874 0.418609 F\n0.563004 0.682556 0.580275 F\n0.187696 0.067731 0.667951 F\n0.315172 0.432574 0.831831 F\n0.064409 0.180214 0.079174 F\n",
"nsites": 60,
"nelements": 6,
"elements": [
"Li",
"V",
"Cr",
"P",
"O",
"F"
],
"chemical_system": "Cr-F-Li-O-P-V",
"density": 3.1689938168531104,
"density_atomic": 0.08473846630133751,
"volume": 708.0609623808233,
"volume_molar": 7.106737970197305,
"formula_full": "Li4 V4 Cr4 P8 O32 F8",
"formula_reduced": "LiVCrP2(O4F)2",
"formula_anonymous": "ABCD2E2F8",
"energy": -463.13738718,
"energy_per_atom": -7.7189564530000006,
"energy_above_hull": null,
"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -422.66138718,
"band_gap": 0.9590999999999998,
"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 15.999858,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:43.995000Z",
"spacegroup": 1
},
{
"id": "mp-1074064",
"created_at": "2022-09-04T14:47:00.027324Z",
"structure_string": "Mg18 Si10\n1.0\n5.046747 0.000000 0.000000\n1.266010 7.776829 0.000000\n2.385793 1.186453 13.866534\nMg Si\n18 10\ndirect\n0.872716 0.910349 0.319665 Mg\n0.474746 0.923451 0.500801 Mg\n0.435583 0.705350 0.322521 Mg\n0.967086 0.153720 0.461998 Mg\n0.964822 0.508550 0.375201 Mg\n0.439751 0.502835 0.528876 Mg\n0.454499 0.903862 0.797030 Mg\n0.078078 0.475186 0.990102 Mg\n0.803221 0.138175 0.857316 Mg\n0.237440 0.089855 0.985229 Mg\n0.654726 0.506079 0.838142 Mg\n0.503200 0.695488 0.011105 Mg\n0.170945 0.618859 0.736408 Mg\n0.923745 0.244109 0.192853 Mg\n0.909500 0.351982 0.646060 Mg\n0.712030 0.964443 0.098678 Mg\n0.981258 0.970260 0.661299 Mg\n0.388691 0.438823 0.191853 Mg\n0.294027 0.270548 0.794442 Si\n0.456765 0.179995 0.627197 Si\n0.004712 0.768992 0.499362 Si\n0.903001 0.631955 0.179069 Si\n0.972858 0.799150 0.901908 Si\n0.360209 0.073646 0.283725 Si\n0.613856 0.310091 0.023307 Si\n0.206345 0.869235 0.155248 Si\n0.521924 0.308535 0.369609 Si\n0.694116 0.686049 0.651318 Si\n",
"nsites": 28,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.1917961850481826,
"density_atomic": 0.05144889212680143,
"volume": 544.2294059703158,
"volume_molar": 11.705093173158666,
"formula_full": "Mg18 Si10",
"formula_reduced": "Mg9Si5",
"formula_anonymous": "A5B9",
"energy": -80.78324353000001,
"energy_per_atom": -2.8851158403571433,
"energy_above_hull": null,
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"formation_energy": null,
"formation_energy_per_atom": null,
"energy_uncorrected": -81.49324353,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 0.0006614,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:50.749000Z",
"spacegroup": 1
},
{
"id": "mp-780774",
"created_at": "2022-09-04T14:47:00.051852Z",
"structure_string": "Li18 Mn4 C16 O48\n1.0\n0.189614 0.033720 -8.376994\n-0.068562 9.624188 0.020229\n11.243946 0.035769 0.046094\nLi Mn C O\n18 4 16 48\ndirect\n0.432220 0.635623 0.065195 Li\n0.938814 0.864120 0.068036 Li\n0.440071 0.153353 0.153801 Li\n0.932509 0.349148 0.145927 Li\n0.301917 0.901684 0.231117 Li\n0.800996 0.602338 0.222167 Li\n0.466445 0.664630 0.341025 Li\n0.975997 0.825915 0.355604 Li\n0.927956 0.427614 0.443026 Li\n0.568091 0.917651 0.581658 Li\n0.529121 0.325917 0.650427 Li\n0.044681 0.161751 0.667298 Li\n0.201266 0.401160 0.772028 Li\n0.707787 0.101386 0.775253 Li\n0.063570 0.639023 0.861989 Li\n0.571071 0.865505 0.869240 Li\n0.067143 0.134053 0.935212 Li\n0.558758 0.365098 0.932560 Li\n0.221072 0.884277 0.725098 Mn\n0.729645 0.596980 0.726583 Mn\n0.272534 0.395388 0.276730 Mn\n0.772031 0.091433 0.277044 Mn\n0.242765 0.385165 0.028175 C\n0.736958 0.111142 0.029040 C\n0.134806 0.638568 0.208522 C\n0.637898 0.860251 0.208472 C\n0.115929 0.140345 0.282705 C\n0.621310 0.364649 0.288090 C\n0.257298 0.851376 0.481270 C\n0.759288 0.654199 0.488918 C\n0.242468 0.355412 0.524504 C\n0.737084 0.152229 0.509255 C\n0.386798 0.642150 0.719928 C\n0.880055 0.860199 0.715041 C\n0.372402 0.135473 0.794529 C\n0.866445 0.359185 0.795642 C\n0.249461 0.883811 0.975158 C\n0.753556 0.613163 0.975707 C\n0.881145 0.675900 0.003695 O\n0.185223 0.985755 0.031070 O\n0.692586 0.509888 0.030777 O\n0.335566 0.340928 0.118992 O\n0.832795 0.150964 0.120207 O\n0.102741 0.768450 0.199363 O\n0.599854 0.733116 0.197035 O\n0.032866 0.540602 0.202464 O\n0.543174 0.964169 0.203779 O\n0.285263 0.601648 0.226754 O\n0.789495 0.893559 0.229393 O\n0.081739 0.270657 0.266941 O\n0.593283 0.231302 0.279398 O\n0.258331 0.097281 0.276955 O\n0.761445 0.412832 0.277683 O\n0.998888 0.053646 0.306544 O\n0.499637 0.447384 0.307901 O\n0.356241 0.832975 0.395053 O\n0.847924 0.653328 0.395157 O\n0.188043 0.430490 0.430813 O\n0.711238 0.044701 0.434204 O\n0.117859 0.802942 0.487854 O\n0.839985 0.242227 0.477863 O\n0.385523 0.317632 0.523664 O\n0.646975 0.738605 0.511358 O\n0.309452 0.930095 0.573475 O\n0.789052 0.551141 0.567538 O\n0.138141 0.330998 0.606833 O\n0.656441 0.151447 0.606291 O\n0.501542 0.554561 0.699290 O\n0.999590 0.946010 0.697394 O\n0.738346 0.905930 0.721004 O\n0.421090 0.774090 0.734860 O\n0.242542 0.602543 0.724176 O\n0.912774 0.728777 0.726483 O\n0.715969 0.395183 0.774715 O\n0.224309 0.088782 0.776417 O\n0.391658 0.267408 0.802742 O\n0.482435 0.045779 0.801932 O\n0.966088 0.458528 0.803708 O\n0.900488 0.229628 0.804632 O\n0.163733 0.831209 0.883337 O\n0.669635 0.661643 0.881658 O\n0.293130 0.492122 0.971808 O\n0.780645 0.001823 0.972211 O\n0.118009 0.316490 0.003920 O\n0.381117 0.826222 0.000699 O\n0.616469 0.185960 0.006528 O\n",
"nsites": 86,
"nelements": 4,
"elements": [
"Li",
"Mn",
"C",
"O"
],
"chemical_system": "C-Li-Mn-O",
"density": 2.38989619830407,
"density_atomic": 0.09485792061642652,
"volume": 906.6190724099365,
"volume_molar": 6.348590313666594,
"formula_full": "Li18 Mn4 C16 O48",
"formula_reduced": "Li9Mn2(CO3)8",
"formula_anonymous": "A2B8C9D24",
"energy": -630.33370011,
"energy_per_atom": -7.329461629186047,
"energy_above_hull": null,
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"energy_uncorrected": -590.68570011,
"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:37:48.665000Z",
"spacegroup": 1
},
{
"id": "mp-758142",
"created_at": "2022-09-04T14:47:00.388460Z",
"structure_string": "Li6 Ti1 Fe3 P6 O24\n1.0\n8.577264 0.000000 0.000000\n4.107318 7.595455 0.000000\n4.089045 2.457388 7.203990\nLi Ti Fe P O\n6 1 3 6 24\ndirect\n0.972899 0.000111 0.991756 Li\n0.253277 0.642961 0.846644 Li\n0.519911 0.502989 0.492005 Li\n0.718088 0.347438 0.152242 Li\n0.345818 0.154697 0.711780 Li\n0.154635 0.717918 0.345963 Li\n0.148885 0.149350 0.150401 Ti\n0.853647 0.861072 0.852511 Fe\n0.645941 0.646183 0.635678 Fe\n0.351669 0.351182 0.349615 Fe\n0.950013 0.556253 0.252511 P\n0.554460 0.254269 0.950360 P\n0.252078 0.952245 0.552960 P\n0.756105 0.041114 0.454552 P\n0.452121 0.755320 0.035759 P\n0.043732 0.460331 0.757012 P\n0.868915 0.501433 0.716921 O\n0.706073 0.878347 0.483364 O\n0.941655 0.735679 0.082239 O\n0.461629 0.709738 0.877745 O\n0.760346 0.560331 0.408820 O\n0.010489 0.382719 0.193752 O\n0.741008 0.096584 0.918293 O\n0.534610 0.423534 0.771374 O\n0.407342 0.759407 0.560820 O\n0.821683 0.997916 0.610646 O\n0.914923 0.071926 0.260013 O\n0.621010 0.808460 0.982477 O\n0.382777 0.189315 0.015516 O\n0.095816 0.922553 0.743625 O\n0.188877 0.008687 0.384878 O\n0.595377 0.229917 0.438473 O\n0.438418 0.596537 0.224851 O\n0.262365 0.919198 0.070748 O\n0.025038 0.615058 0.812098 O\n0.229180 0.434825 0.594978 O\n0.537884 0.310199 0.102110 O\n0.067788 0.267318 0.918265 O\n0.313326 0.101978 0.530965 O\n0.100190 0.533912 0.316282 O\n",
"nsites": 40,
"nelements": 5,
"elements": [
"Li",
"Ti",
"Fe",
"P",
"O"
],
"chemical_system": "Fe-Li-O-P-Ti",
"density": 2.925592949773846,
"density_atomic": 0.08522839647671081,
"volume": 469.3271451015771,
"volume_molar": 7.0658853257266045,
"formula_full": "Li6 Ti1 Fe3 P6 O24",
"formula_reduced": "Li6TiFe3(PO4)6",
"formula_anonymous": "AB3C6D6E24",
"energy": -299.76034541,
"energy_per_atom": -7.49400863525,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -276.50434541,
"band_gap": 1.3799,
"is_gap_direct": true,
"is_magnetic": true,
"total_magnetization": 14.0000001,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:45.681000Z",
"spacegroup": 1
},
{
"id": "mp-1074178",
"created_at": "2022-09-04T14:47:00.355291Z",
"structure_string": "Mg8 Si14\n1.0\n4.019019 0.000000 0.000000\n-0.309922 7.116899 0.000000\n-1.828383 -1.457467 14.222926\nMg Si\n8 14\ndirect\n0.160599 0.188887 0.934505 Mg\n0.951107 0.354411 0.506034 Mg\n0.361086 0.172519 0.361736 Mg\n0.536953 0.565773 0.649807 Mg\n0.126783 0.587191 0.826724 Mg\n0.609201 0.472711 0.116290 Mg\n0.444093 0.637756 0.419996 Mg\n0.478972 0.047040 0.578463 Mg\n0.695585 0.460511 0.937622 Si\n0.621335 0.794139 0.963913 Si\n0.167528 0.844062 0.059406 Si\n0.200590 0.162814 0.121946 Si\n0.003441 0.741753 0.556406 Si\n0.904554 0.965398 0.442074 Si\n0.748877 0.153471 0.216005 Si\n0.558657 0.941331 0.814630 Si\n0.025382 0.259387 0.686982 Si\n0.184857 0.680641 0.213165 Si\n0.892552 0.445602 0.317228 Si\n0.567550 0.283536 0.787883 Si\n0.018676 0.901580 0.713636 Si\n0.737935 0.843107 0.279093 Si\n",
"nsites": 22,
"nelements": 2,
"elements": [
"Mg",
"Si"
],
"chemical_system": "Mg-Si",
"density": 2.3986032512980775,
"density_atomic": 0.054078279798149914,
"volume": 406.8176739740277,
"volume_molar": 11.135969528760834,
"formula_full": "Mg8 Si14",
"formula_reduced": "Mg4Si7",
"formula_anonymous": "A4B7",
"energy": -85.37784623,
"energy_per_atom": -3.8808111922727275,
"energy_above_hull": null,
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"energy_uncorrected": -86.37184623,
"band_gap": 0.0,
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"total_magnetization": 8.69e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:49.930000Z",
"spacegroup": 1
},
{
"id": "mp-1176176",
"created_at": "2022-09-04T14:47:00.188646Z",
"structure_string": "Li9 Mn2 Co5 O16\n1.0\n3.022720 0.000000 0.000000\n1.260130 9.686247 0.000000\n0.281255 0.435899 9.976471\nLi Mn Co O\n9 2 5 16\ndirect\n0.867129 0.256791 0.811380 Li\n0.131829 0.746388 0.686076 Li\n0.378992 0.251888 0.563408 Li\n0.628263 0.751638 0.441241 Li\n0.874075 0.248399 0.308415 Li\n0.118788 0.747889 0.186569 Li\n0.360415 0.254847 0.065439 Li\n0.637763 0.741738 0.937107 Li\n0.250711 0.499612 0.875003 Li\n0.998691 0.000069 0.999649 Mn\n0.250613 0.500009 0.375016 Mn\n0.494173 0.999509 0.748635 Co\n0.765957 0.499360 0.635611 Co\n0.000423 0.001362 0.500307 Co\n0.506178 0.999158 0.251646 Co\n0.734380 0.501052 0.114306 Co\n0.398955 0.118312 0.901174 O\n0.695240 0.614961 0.763738 O\n0.946468 0.114610 0.653033 O\n0.168232 0.614832 0.528309 O\n0.456475 0.116086 0.403245 O\n0.664771 0.610893 0.272646 O\n0.960924 0.113135 0.155887 O\n0.155041 0.613935 0.038334 O\n0.349919 0.385858 0.711179 O\n0.542446 0.886123 0.595695 O\n0.836600 0.389235 0.477501 O\n0.055356 0.884354 0.348053 O\n0.331803 0.385236 0.222137 O\n0.595054 0.883763 0.097777 O\n0.803702 0.384586 0.986856 O\n0.040636 0.884371 0.844628 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
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