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{
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"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=-spacegroup&page=11575",
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"results": [
{
"id": "mp-1176116",
"created_at": "2022-09-04T14:45:38.584393Z",
"structure_string": "Li9 Mn2 Co5 O16\n1.0\n2.989263 0.000000 0.000000\n0.355545 9.777752 0.000000\n0.171207 2.208457 9.881728\nLi Mn Co O\n9 2 5 16\ndirect\n0.001278 0.751533 0.873482 Li\n0.498133 0.501859 0.488563 Li\n0.006902 0.249131 0.128431 Li\n0.497605 0.000047 0.747273 Li\n0.491418 0.496414 0.004669 Li\n0.002393 0.251082 0.623611 Li\n0.509309 0.004617 0.256040 Li\n0.989886 0.740198 0.373979 Li\n0.012618 0.503299 0.258323 Li\n0.990892 0.001105 0.996627 Mn\n0.490776 0.740768 0.129842 Mn\n0.499472 0.750216 0.624555 Co\n0.508935 0.252301 0.874395 Co\n0.001017 0.001315 0.498672 Co\n0.005999 0.499733 0.749221 Co\n0.504048 0.259418 0.371057 Co\n0.451823 0.875191 0.946791 O\n0.011036 0.623483 0.572815 O\n0.501106 0.358119 0.205867 O\n0.967589 0.131290 0.819408 O\n0.002279 0.638535 0.071535 O\n0.516325 0.375667 0.701269 O\n0.967805 0.123028 0.322969 O\n0.505540 0.874800 0.447984 O\n0.495762 0.627617 0.802306 O\n0.032523 0.362293 0.433648 O\n0.531898 0.125693 0.051620 O\n0.987159 0.879332 0.676612 O\n0.045749 0.375595 0.928971 O\n0.491750 0.129009 0.544566 O\n0.978496 0.863172 0.173635 O\n0.502482 0.634139 0.301270 O\n",
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"Co",
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],
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"volume": 288.8258365490411,
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"formula_full": "Li9 Mn2 Co5 O16",
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"updated_at": "2021-11-28T01:37:18.610000Z",
"spacegroup": 1
},
{
"id": "mp-627119",
"created_at": "2022-09-04T14:45:38.597382Z",
"structure_string": "V4 H4 O12\n1.0\n3.634134 0.000000 0.000000\n-1.745491 5.923814 0.000000\n-0.005919 -0.781760 12.115835\nV H O\n4 4 12\ndirect\n0.921527 0.849066 0.863236 V\n0.078726 0.151050 0.136513 V\n0.219102 0.432026 0.863378 V\n0.781378 0.567505 0.136592 V\n0.592320 0.382956 0.501931 H\n0.887829 0.244209 0.488687 H\n0.108979 0.706747 0.484781 H\n0.447037 0.915714 0.507126 H\n0.385886 0.775419 0.893437 O\n0.614247 0.224277 0.106256 O\n0.074127 0.146734 0.912708 O\n0.926234 0.853395 0.087895 O\n0.755965 0.508481 0.899943 O\n0.244514 0.491505 0.099772 O\n0.922154 0.850793 0.731535 O\n0.078750 0.151648 0.268456 O\n0.201027 0.395068 0.731677 O\n0.799722 0.602229 0.268295 O\n0.614926 0.229756 0.492366 O\n0.382880 0.750067 0.500661 O\n",
"nsites": 20,
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"elements": [
"V",
"H",
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],
"chemical_system": "H-O-V",
"density": 2.5452235431732553,
"density_atomic": 0.07667862116580344,
"volume": 260.82889462440477,
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"formula_full": "V4 H4 O12",
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"formula_anonymous": "ABC3",
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"updated_at": "2021-11-28T01:37:04.216000Z",
"spacegroup": 1
},
{
"id": "mp-755719",
"created_at": "2022-09-04T14:45:38.689978Z",
"structure_string": "V4 O5 F7\n1.0\n5.202237 0.000000 0.000000\n-0.019309 5.388270 0.000000\n-0.033715 -0.273965 7.503193\nV O F\n4 5 7\ndirect\n0.520064 0.511970 0.495897 V\n0.532201 0.529758 0.983484 V\n0.971019 0.011522 0.494553 V\n0.033096 0.020479 0.995588 V\n0.281782 0.204196 0.961556 O\n0.576071 0.498701 0.761030 O\n0.722602 0.207669 0.459951 O\n0.708409 0.780279 0.041086 O\n0.771295 0.707220 0.463889 O\n0.095952 0.980917 0.249960 F\n0.221823 0.286795 0.540280 F\n0.204499 0.695356 0.955881 F\n0.269895 0.787312 0.545432 F\n0.408223 0.492811 0.243905 F\n0.782950 0.287856 0.054985 F\n0.900120 0.997159 0.752519 F\n",
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"density": 3.290341720370921,
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"volume": 210.32243486671405,
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"formula_full": "V4 O5 F7",
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"spacegroup": 1
},
{
"id": "mp-757168",
"created_at": "2022-09-04T14:45:38.606110Z",
"structure_string": "Li2 P8 W2 O26\n1.0\n5.243422 0.000000 0.000000\n1.390936 7.971236 0.000000\n1.016274 2.587318 13.743396\nLi P W O\n2 8 2 26\ndirect\n0.555801 0.460938 0.997595 Li\n0.010192 0.609419 0.514042 Li\n0.127142 0.797085 0.128611 P\n0.997453 0.878970 0.655169 P\n0.348055 0.581174 0.312926 P\n0.306936 0.653712 0.803609 P\n0.673662 0.341254 0.204992 P\n0.636974 0.427485 0.679177 P\n0.984569 0.102111 0.350837 P\n0.865438 0.207314 0.859314 P\n0.432015 0.049010 0.753807 W\n0.555765 0.948506 0.240387 W\n0.162413 0.015920 0.666716 O\n0.171631 0.637937 0.220319 O\n0.270890 0.017425 0.329349 O\n0.192663 0.557744 0.404615 O\n0.164290 0.739605 0.034754 O\n0.059086 0.797490 0.569205 O\n0.031276 0.734805 0.757123 O\n0.158833 0.129092 0.843871 O\n0.299146 0.926912 0.145603 O\n0.300721 0.511822 0.887057 O\n0.541473 0.197752 0.180956 O\n0.505878 0.400172 0.297318 O\n0.455792 0.293225 0.684663 O\n0.550228 0.702524 0.304372 O\n0.467752 0.595722 0.709375 O\n0.430396 0.805208 0.821604 O\n0.692711 0.482132 0.121368 O\n0.706547 0.072195 0.840379 O\n0.840141 0.881386 0.152330 O\n0.943105 0.254484 0.251858 O\n0.937819 0.168476 0.441645 O\n0.800019 0.269570 0.951505 O\n0.773835 0.478407 0.585652 O\n0.707176 0.962304 0.665709 O\n0.834655 0.361909 0.765676 O\n0.813581 0.969746 0.334958 O\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Li",
"P",
"W",
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],
"chemical_system": "Li-O-P-W",
"density": 3.0218344721950183,
"density_atomic": 0.06615292583720961,
"volume": 574.4265959378899,
"volume_molar": 9.103362676383203,
"formula_full": "Li2 P8 W2 O26",
"formula_reduced": "LiP4WO13",
"formula_anonymous": "ABC4D13",
"energy": -297.43227937,
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"spacegroup": 1
},
{
"id": "mp-760997",
"created_at": "2022-09-04T14:45:38.667527Z",
"structure_string": "Li12 Mn4 P8 O32\n1.0\n8.087941 0.000000 0.000000\n-2.540215 8.083367 0.000000\n-0.003552 -0.008750 10.413899\nLi Mn P O\n12 4 8 32\ndirect\n0.636862 0.128360 0.143250 Li\n0.469612 0.229467 0.439712 Li\n0.823637 0.353063 0.834890 Li\n0.514976 0.267388 0.928612 Li\n0.385726 0.394973 0.171117 Li\n0.385252 0.393247 0.666218 Li\n0.642578 0.642145 0.354455 Li\n0.814316 0.846873 0.668135 Li\n0.186968 0.654352 0.153534 Li\n0.511896 0.775766 0.582736 Li\n0.352751 0.833740 0.853186 Li\n0.392337 0.901220 0.332426 Li\n0.891585 0.353351 0.335865 Mn\n0.114886 0.133559 0.841471 Mn\n0.107380 0.633427 0.657605 Mn\n0.881379 0.858380 0.154763 Mn\n0.787292 0.044651 0.419206 P\n0.271110 0.021942 0.088628 P\n0.716431 0.481361 0.582937 P\n0.793749 0.542848 0.084883 P\n0.210795 0.447443 0.917256 P\n0.288926 0.523893 0.411071 P\n0.713979 0.981943 0.901969 P\n0.212024 0.949437 0.586284 P\n0.676474 0.142589 0.341059 O\n0.957684 0.192663 0.437532 O\n0.665212 0.139867 0.874517 O\n0.096308 0.033179 0.146973 O\n0.200813 0.093465 0.670397 O\n0.413210 0.191054 0.107364 O\n0.574703 0.317687 0.607193 O\n0.811700 0.396030 0.166973 O\n0.879922 0.478836 0.668600 O\n0.321743 0.343509 0.850180 O\n0.715408 0.476449 0.957130 O\n0.771967 0.497520 0.439325 O\n0.029755 0.309358 0.915189 O\n0.378906 0.400791 0.359464 O\n0.689280 0.641446 0.163551 O\n0.972493 0.684036 0.076175 O\n0.652114 0.628015 0.620479 O\n0.237880 0.493720 0.555590 O\n0.273738 0.505190 0.050208 O\n0.123543 0.516560 0.327058 O\n0.200585 0.591391 0.830304 O\n0.416790 0.700626 0.397226 O\n0.583848 0.825847 0.850640 O\n0.810105 0.905918 0.330995 O\n0.890061 0.981683 0.829258 O\n0.310487 0.836768 0.658371 O\n0.706406 0.971703 0.544406 O\n0.746618 0.979510 0.049997 O\n0.029002 0.812054 0.579751 O\n0.330994 0.886080 0.154132 O\n0.294073 0.009510 0.458169 O\n0.245486 0.991076 0.940600 O\n",
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"formula_full": "Li12 Mn4 P8 O32",
"formula_reduced": "Li3Mn(PO4)2",
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"energy": -406.09532256,
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{
"id": "mp-753921",
"created_at": "2022-09-04T14:45:39.084086Z",
"structure_string": "Sb11 S18\n1.0\n6.861754 0.000000 0.000000\n2.197613 7.413895 0.000000\n2.358864 3.255556 14.892793\nSb S\n11 18\ndirect\n0.284757 0.215543 0.922302 Sb\n0.146997 0.866799 0.196599 Sb\n0.525157 0.576364 0.609993 Sb\n0.483377 0.933583 0.386221 Sb\n0.282627 0.717681 0.920753 Sb\n0.714932 0.291247 0.067776 Sb\n0.152421 0.366221 0.193157 Sb\n0.522932 0.056068 0.608944 Sb\n0.493808 0.426830 0.393063 Sb\n0.888182 0.125351 0.801268 Sb\n0.721617 0.786250 0.064493 Sb\n0.984862 0.997464 0.002627 S\n0.140255 0.317805 0.774135 S\n0.533717 0.422069 0.876539 S\n0.198064 0.773921 0.358592 S\n0.717789 0.586930 0.460463 S\n0.977756 0.508331 0.005152 S\n0.141677 0.832671 0.772762 S\n0.286064 0.910952 0.538251 S\n0.754732 0.736316 0.656491 S\n0.442167 0.082876 0.127977 S\n0.548532 0.918155 0.887748 S\n0.200287 0.266497 0.356467 S\n0.717763 0.091477 0.459626 S\n0.866835 0.176123 0.221754 S\n0.279880 0.410738 0.537047 S\n0.799361 0.227981 0.641973 S\n0.445329 0.575169 0.126364 S\n0.871165 0.676288 0.223376 S\n",
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},
{
"id": "mp-584116",
"created_at": "2022-09-04T14:45:38.995932Z",
"structure_string": "Bi3 P2 O10\n1.0\n5.565872 0.000000 0.000000\n-0.785913 6.748404 0.000000\n-2.328531 -2.478213 6.192543\nBi P O\n3 2 10\ndirect\n0.601076 0.823243 0.246054 Bi\n0.264472 0.589989 0.674993 Bi\n0.018174 0.997693 0.991722 Bi\n0.615351 0.388804 0.334599 P\n0.249124 0.055809 0.579075 P\n0.085508 0.910608 0.654704 O\n0.195102 0.728339 0.983720 O\n0.660165 0.771145 0.934634 O\n0.056959 0.026957 0.346090 O\n0.381187 0.486001 0.360843 O\n0.492203 0.972220 0.576184 O\n0.826307 0.418944 0.555633 O\n0.735722 0.504532 0.217482 O\n0.502622 0.145589 0.194245 O\n0.319057 0.289787 0.735988 O\n",
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"formula_full": "Bi3 P2 O10",
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{
"id": "mp-1293011",
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"structure_string": "Li8 V4 O4 F12\n1.0\n0.001611 5.054516 0.012014\n-8.277554 -0.016187 -5.293801\n-2.719363 0.009635 5.355193\nLi V O F\n8 4 4 12\ndirect\n0.011517 0.226885 0.646694 Li\n0.007971 0.727167 0.133645 Li\n0.477071 0.474875 0.893881 Li\n0.476206 0.977701 0.397081 Li\n0.477981 0.118743 0.810034 Li\n0.483063 0.613056 0.309872 Li\n0.014744 0.366776 0.059868 Li\n0.004948 0.879998 0.565259 Li\n0.021589 0.509495 0.499738 V\n0.471186 0.260547 0.249167 V\n0.022375 0.009567 0.000581 V\n0.467743 0.758007 0.749076 V\n0.202569 0.179219 0.047370 O\n0.208631 0.668560 0.573580 O\n0.295666 0.430474 0.288646 O\n0.285759 0.930897 0.794464 O\n0.344745 0.164734 0.521140 F\n0.349313 0.667285 0.026696 F\n0.143687 0.412878 0.768084 F\n0.143895 0.910479 0.273245 F\n0.832418 0.065705 0.715801 F\n0.839059 0.567239 0.220158 F\n0.661299 0.315963 0.964163 F\n0.656774 0.816191 0.469649 F\n0.687448 0.074131 0.187696 F\n0.688439 0.573662 0.689851 F\n0.807252 0.324508 0.433833 F\n0.800329 0.825576 0.934484 F\n",
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"formula_full": "Li8 V4 O4 F12",
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{
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{
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{
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"structure_string": "Li7 Mn4 Co1 O12\n1.0\n2.960577 0.000000 0.000000\n0.363674 5.981506 0.000000\n0.377366 2.903796 12.255201\nLi Mn Co O\n7 4 1 12\ndirect\n0.002231 0.488417 0.011064 Li\n0.499239 0.329879 0.834514 Li\n0.499322 0.666522 0.166376 Li\n0.997175 0.842263 0.324638 Li\n0.501768 0.003226 0.499635 Li\n0.999951 0.169046 0.664555 Li\n0.500096 0.167323 0.167729 Li\n0.003989 0.004156 0.008568 Mn\n0.996626 0.330611 0.327158 Mn\n0.504874 0.837112 0.833254 Mn\n0.999782 0.663964 0.664277 Mn\n0.490633 0.495336 0.498756 Co\n0.482368 0.219677 0.000749 O\n0.036456 0.071443 0.841696 O\n0.003754 0.414761 0.179310 O\n0.478106 0.551473 0.340365 O\n0.030852 0.733252 0.502322 O\n0.535455 0.906559 0.671036 O\n0.521252 0.781022 0.995744 O\n0.967114 0.594364 0.828363 O\n0.995803 0.919993 0.155699 O\n0.518559 0.114821 0.334570 O\n0.966259 0.268957 0.491910 O\n0.468334 0.425821 0.657714 O\n",
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"formula_full": "Li7 Mn4 Co1 O12",
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{
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"structure_string": "Li4 Fe1 Te2 W1 O12\n1.0\n5.207198 0.000000 0.000000\n-0.007270 5.488641 0.000000\n-0.014697 -0.557885 7.525524\nLi Fe Te W O\n4 1 2 1 12\ndirect\n0.995107 0.445314 0.303953 Li\n0.498334 0.919570 0.763345 Li\n0.008751 0.479867 0.746122 Li\n0.496055 0.903669 0.310570 Li\n0.500335 0.487521 0.500919 Fe\n0.002804 0.001041 0.503798 Te\n0.500399 0.489161 0.000508 Te\n0.000839 0.999347 0.004153 W\n0.293539 0.188121 0.428411 O\n0.127651 0.017047 0.753021 O\n0.310953 0.838562 0.060686 O\n0.191428 0.709233 0.434311 O\n0.826175 0.697363 0.930092 O\n0.383056 0.528173 0.752795 O\n0.620219 0.517470 0.247620 O\n0.160558 0.321637 0.059844 O\n0.828705 0.310895 0.548298 O\n0.688105 0.175700 0.927402 O\n0.870088 0.003109 0.244062 O\n0.696899 0.824803 0.551289 O\n",
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}