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"results": [
{
"id": "mp-1245201",
"created_at": "2022-09-04T14:45:39.722637Z",
"structure_string": "Zn50 S50\n1.0\n13.572065 -0.630150 -0.213415\n-0.630625 13.177225 1.113786\n-0.222383 1.059222 13.306851\nZn S\n50 50\ndirect\n0.916152 0.103212 0.651241 Zn\n0.221914 0.455207 0.653055 Zn\n0.850852 0.129362 0.038678 Zn\n0.645054 0.481708 0.572138 Zn\n0.119232 0.883578 0.771450 Zn\n0.449101 0.087542 0.288874 Zn\n0.838680 0.557219 0.336523 Zn\n0.442423 0.929461 0.222343 Zn\n0.551621 0.557293 0.823657 Zn\n0.689579 0.954526 0.121367 Zn\n0.867184 0.378360 0.534293 Zn\n0.431810 0.999399 0.857071 Zn\n0.107314 0.698192 0.209297 Zn\n0.958329 0.238100 0.830402 Zn\n0.558849 0.720992 0.476280 Zn\n0.502224 0.698014 0.045286 Zn\n0.168191 0.693733 0.881033 Zn\n0.147187 0.873851 0.359756 Zn\n0.256457 0.250575 0.148306 Zn\n0.306662 0.539673 0.209791 Zn\n0.086058 0.293130 0.975708 Zn\n0.245874 0.113521 0.936085 Zn\n0.621272 0.283738 0.466945 Zn\n0.597714 0.863971 0.764188 Zn\n0.418336 0.652688 0.616649 Zn\n0.959862 0.700087 0.958571 Zn\n0.483022 0.024509 0.553583 Zn\n0.557647 0.491227 0.274564 Zn\n0.823368 0.269980 0.295015 Zn\n0.353079 0.255560 0.862057 Zn\n0.018909 0.779539 0.502769 Zn\n0.718718 0.903418 0.625607 Zn\n0.058288 0.130522 0.229249 Zn\n0.539332 0.307053 0.090953 Zn\n0.756256 0.364848 0.915175 Zn\n0.263145 0.815183 0.049597 Zn\n0.670322 0.917536 0.370750 Zn\n0.140687 0.223538 0.637596 Zn\n0.153670 0.734470 0.687650 Zn\n0.932860 0.409712 0.109433 Zn\n0.721317 0.739039 0.756218 Zn\n0.653815 0.721740 0.220590 Zn\n0.396389 0.386533 0.465680 Zn\n0.261038 0.711933 0.400076 Zn\n0.097198 0.383455 0.287382 Zn\n0.234009 0.534055 0.939037 Zn\n0.879851 0.928563 0.218177 Zn\n0.974325 0.421900 0.863921 Zn\n0.089086 0.612763 0.462030 Zn\n0.957135 0.830883 0.656916 Zn\n0.549282 0.847993 0.126101 S\n0.520073 0.275849 0.836206 S\n0.229293 0.995662 0.455042 S\n0.686858 0.333823 0.174626 S\n0.234157 0.349562 0.539234 S\n0.133835 0.135290 0.058302 S\n0.966298 0.749276 0.124552 S\n0.830336 0.478844 0.773117 S\n0.792309 0.205474 0.886613 S\n0.116992 0.575816 0.640952 S\n0.110939 0.825753 0.955082 S\n0.561991 0.714361 0.878587 S\n0.191718 0.402546 0.069671 S\n0.612059 0.592709 0.130888 S\n0.924058 0.554821 0.486882 S\n0.742702 0.035900 0.256487 S\n0.535668 0.020785 0.733229 S\n0.004152 0.531884 0.980757 S\n0.414798 0.501226 0.729837 S\n0.577920 0.388453 0.919108 S\n0.680526 0.481455 0.395034 S\n0.614747 0.626434 0.648676 S\n0.132882 0.070529 0.765642 S\n0.853300 0.726462 0.233235 S\n0.410434 0.194207 0.130617 S\n0.871558 0.970553 0.569060 S\n0.406691 0.631559 0.447966 S\n0.782328 0.237396 0.465344 S\n0.767833 0.436738 0.064941 S\n0.883975 0.729737 0.798102 S\n0.294948 0.431449 0.820212 S\n0.988141 0.060254 0.821512 S\n0.346823 0.973967 0.994621 S\n0.921683 0.222021 0.158114 S\n0.981457 0.271092 0.643816 S\n0.173101 0.236630 0.305448 S\n0.309209 0.786875 0.615087 S\n0.697000 0.746089 0.381926 S\n0.762295 0.384258 0.673426 S\n0.312621 0.948313 0.583177 S\n0.400621 0.416613 0.290304 S\n0.243696 0.821675 0.232079 S\n0.166560 0.553562 0.305069 S\n0.332888 0.655615 0.061398 S\n0.577032 0.896725 0.512692 S\n0.010695 0.968264 0.319568 S\n0.521332 0.347451 0.576885 S\n0.934058 0.424625 0.279302 S\n0.485746 0.162943 0.428162 S\n0.836491 0.954673 0.044575 S\n",
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"elements": [
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],
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"density": 3.4318424060660697,
"density_atomic": 0.04240523225190109,
"volume": 2358.199559100796,
"volume_molar": 14.20140968507493,
"formula_full": "Zn50 S50",
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"spacegroup": 1
},
{
"id": "mp-559463",
"created_at": "2022-09-04T14:45:28.815785Z",
"structure_string": "Rb2 Mg2 As2 H24 O20\n1.0\n6.258251 0.000000 0.000000\n0.000000 7.080259 0.000000\n0.000000 0.000000 11.521884\nRb Mg As H O\n2 2 2 24 20\ndirect\n0.643547 0.000000 0.738070 Rb\n0.356453 0.500000 0.238070 Rb\n0.612972 0.000000 0.387693 Mg\n0.387028 0.500000 0.887693 Mg\n0.977286 0.500000 0.518653 As\n0.022714 0.000000 0.018653 As\n0.645154 0.258940 0.019200 H\n0.809313 0.319588 0.315716 H\n0.720110 0.500000 0.724263 H\n0.407300 0.820230 0.033229 H\n0.190687 0.819588 0.815716 H\n0.354846 0.241060 0.519200 H\n0.833346 0.500000 0.851395 H\n0.645154 0.741060 0.019200 H\n0.407300 0.179770 0.033229 H\n0.989375 0.114355 0.506644 H\n0.212635 0.699895 0.698916 H\n0.190687 0.180412 0.815716 H\n0.212635 0.300105 0.698916 H\n0.592700 0.679770 0.533229 H\n0.809313 0.680412 0.315716 H\n0.010625 0.385645 0.006644 H\n0.989375 0.885645 0.506644 H\n0.354846 0.758940 0.519200 H\n0.279890 0.000000 0.224263 H\n0.787365 0.800105 0.198916 H\n0.166654 0.000000 0.351395 H\n0.592700 0.320230 0.533229 H\n0.010625 0.614355 0.006644 H\n0.787365 0.199895 0.198916 H\n0.949521 0.500000 0.370296 O\n0.726824 0.500000 0.583209 O\n0.491644 0.292233 0.004802 O\n0.273176 0.000000 0.083209 O\n0.508356 0.792233 0.504802 O\n0.280390 0.280829 0.777034 O\n0.890820 0.798900 0.063959 O\n0.890820 0.201100 0.063959 O\n0.109180 0.298900 0.563959 O\n0.050479 0.000000 0.870296 O\n0.280390 0.719171 0.777034 O\n0.926811 0.000000 0.466471 O\n0.694762 0.500000 0.811029 O\n0.491644 0.707767 0.004802 O\n0.073189 0.500000 0.966471 O\n0.109180 0.701100 0.563959 O\n0.719610 0.219171 0.277034 O\n0.508356 0.207767 0.504802 O\n0.305238 0.000000 0.311029 O\n0.719610 0.780829 0.277034 O\n",
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"elements": [
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"As",
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],
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"density": 2.3209108195195123,
"density_atomic": 0.0979364558615991,
"volume": 510.53511749147344,
"volume_molar": 6.149028680913583,
"formula_full": "Rb2 Mg2 As2 H24 O20",
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"spacegroup": 31
},
{
"id": "mp-32669",
"created_at": "2022-09-04T14:45:43.183489Z",
"structure_string": "Ag4 S2\n1.0\n2.390031 -3.531984 0.000000\n2.390031 3.531984 0.000000\n0.000000 0.000000 7.589422\nAg S\n4 2\ndirect\n0.493457 0.506543 0.691216 Ag\n0.506543 0.493457 0.191216 Ag\n0.105995 0.894005 0.935349 Ag\n0.894005 0.105995 0.435349 Ag\n0.283290 0.716710 0.436182 S\n0.716710 0.283290 0.936182 S\n",
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],
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"volume": 128.132989564584,
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"formula_full": "Ag4 S2",
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"energy": -20.90880487,
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"spacegroup": 36
},
{
"id": "mp-752941",
"created_at": "2022-09-04T14:45:28.807045Z",
"structure_string": "Fe4 O4 F4\n1.0\n0.000000 0.000004 3.097984\n3.859375 6.841577 0.000008\n-7.757125 0.021857 -0.000001\nFe O F\n4 4 4\ndirect\n0.750000 0.136602 0.443817 Fe\n0.250001 0.863398 0.556182 Fe\n0.749999 0.136600 0.943815 Fe\n0.250001 0.863400 0.056185 Fe\n0.250000 0.929544 0.838837 O\n0.250000 0.929548 0.338840 O\n0.750000 0.070457 0.161163 O\n0.750000 0.070452 0.661159 O\n0.249998 0.318096 0.534187 F\n0.249998 0.318088 0.034182 F\n0.750002 0.681903 0.465814 F\n0.750002 0.681911 0.965819 F\n",
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],
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"density": 3.6641537554909793,
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"formula_full": "Fe4 O4 F4",
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{
"id": "mp-1042908",
"created_at": "2022-09-04T14:45:32.166828Z",
"structure_string": "Ca3 V6 Fe4 O24\n1.0\n6.879780 0.000000 0.000000\n-2.078928 8.376752 0.000000\n-2.799686 -3.527505 9.042638\nCa V Fe O\n3 6 4 24\ndirect\n0.000000 0.500000 0.500000 Ca\n0.291238 0.306428 0.795734 Ca\n0.708762 0.693572 0.204266 Ca\n0.786990 0.336444 0.738713 V\n0.213010 0.663556 0.261287 V\n0.888047 0.905211 0.666366 V\n0.397015 0.744226 0.863629 V\n0.111953 0.094789 0.333634 V\n0.602985 0.255774 0.136371 V\n0.374731 0.955920 0.601272 Fe\n0.625269 0.044080 0.398728 Fe\n0.046702 0.210476 0.028043 Fe\n0.953298 0.789524 0.971957 Fe\n0.841741 0.698541 0.580815 O\n0.158259 0.301459 0.419185 O\n0.252527 0.537065 0.736953 O\n0.747473 0.462935 0.263047 O\n0.792520 0.284104 0.557944 O\n0.207480 0.715896 0.442056 O\n0.665142 0.960594 0.575301 O\n0.334858 0.039406 0.424699 O\n0.644499 0.743800 0.981136 O\n0.355501 0.256200 0.018864 O\n0.462197 0.786609 0.272852 O\n0.537803 0.213391 0.727148 O\n0.124845 0.017234 0.648709 O\n0.072072 0.054240 0.143462 O\n0.927928 0.945760 0.856538 O\n0.568194 0.128755 0.239873 O\n0.431806 0.871245 0.760127 O\n0.178116 0.452618 0.181315 O\n0.821884 0.547382 0.818685 O\n0.985719 0.280543 0.850310 O\n0.014281 0.719457 0.149690 O\n0.237207 0.797150 0.961290 O\n0.762793 0.202850 0.038710 O\n0.875155 0.982766 0.351291 O\n",
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"formula_full": "Ca3 V6 Fe4 O24",
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{
"id": "mp-1043218",
"created_at": "2022-09-04T14:45:31.102174Z",
"structure_string": "V4 Zn4 Ge8 O24\n1.0\n5.278685 -0.040731 1.138931\n1.346271 6.735743 0.622918\n-5.399367 -0.188507 12.654805\nV Zn Ge O\n4 4 8 24\ndirect\n0.296331 0.907410 0.546293 V\n0.203657 0.092601 0.953720 V\n0.796309 0.907430 0.046239 V\n0.703678 0.092598 0.453733 V\n0.124590 0.250889 0.374550 Zn\n0.624534 0.250880 0.874553 Zn\n0.375469 0.749123 0.125439 Zn\n0.875416 0.749104 0.625456 Zn\n0.859221 0.391024 0.105865 Ge\n0.359285 0.390984 0.605921 Ge\n0.051138 0.788166 0.304526 Ge\n0.551127 0.788184 0.804497 Ge\n0.640728 0.609001 0.394089 Ge\n0.140764 0.608993 0.894136 Ge\n0.448831 0.211818 0.195481 Ge\n0.948890 0.211828 0.695486 Ge\n0.745059 0.299103 0.207692 O\n0.245024 0.299121 0.707756 O\n0.313124 0.584509 0.350425 O\n0.813160 0.584480 0.850486 O\n0.754968 0.700869 0.292249 O\n0.254990 0.700815 0.792298 O\n0.186813 0.415543 0.149515 O\n0.686899 0.415483 0.649618 O\n0.422040 0.140801 0.314125 O\n0.922054 0.140798 0.814209 O\n0.821746 0.371619 0.429608 O\n0.321733 0.371595 0.929615 O\n0.077987 0.859204 0.185815 O\n0.577984 0.859205 0.685881 O\n0.678188 0.628359 0.070355 O\n0.178313 0.628365 0.570417 O\n0.867406 0.206296 0.015311 O\n0.367398 0.206314 0.515353 O\n0.044728 0.969314 0.396834 O\n0.544684 0.969394 0.896871 O\n0.632626 0.793689 0.484655 O\n0.132590 0.793736 0.984662 O\n0.455251 0.030654 0.103091 O\n0.955264 0.030696 0.603178 O\n",
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{
"id": "mp-557930",
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{
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