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{
"id": "mp-1042727",
"created_at": "2022-09-04T14:41:22.399370Z",
"structure_string": "Zn8 Co8 Bi8 O40\n1.0\n5.652721 0.000000 0.000000\n0.000000 10.763542 0.000000\n0.000000 0.000000 15.076387\nZn Co Bi O\n8 8 8 40\ndirect\n0.421401 0.358282 0.526018 Zn\n0.921401 0.141718 0.526018 Zn\n0.921401 0.641718 0.973982 Zn\n0.078599 0.358282 0.026018 Zn\n0.578599 0.141718 0.026018 Zn\n0.078599 0.858282 0.473982 Zn\n0.578599 0.641718 0.473982 Zn\n0.421401 0.858282 0.973982 Zn\n0.920978 0.388768 0.404614 Co\n0.579022 0.888768 0.595386 Co\n0.079022 0.611232 0.595386 Co\n0.420978 0.111232 0.404614 Co\n0.079022 0.111232 0.904614 Co\n0.920978 0.888768 0.095386 Co\n0.579022 0.388768 0.904614 Co\n0.420978 0.611232 0.095386 Co\n0.029445 0.843119 0.773592 Bi\n0.970555 0.156881 0.226408 Bi\n0.470555 0.343119 0.226408 Bi\n0.970555 0.656881 0.273592 Bi\n0.529445 0.156881 0.726408 Bi\n0.529445 0.656881 0.773592 Bi\n0.470555 0.843119 0.273592 Bi\n0.029445 0.343119 0.726408 Bi\n0.795342 0.297428 0.313556 O\n0.333234 0.043049 0.953002 O\n0.166766 0.543049 0.046998 O\n0.357031 0.802289 0.847970 O\n0.142969 0.302289 0.152030 O\n0.795342 0.797428 0.186444 O\n0.142969 0.802289 0.347970 O\n0.704658 0.797428 0.686444 O\n0.333234 0.543049 0.546998 O\n0.204658 0.702572 0.686444 O\n0.704658 0.297428 0.813556 O\n0.585591 0.196822 0.483917 O\n0.833234 0.956951 0.546998 O\n0.642969 0.697711 0.347970 O\n0.108545 0.993241 0.153480 O\n0.833234 0.456951 0.953002 O\n0.204658 0.202572 0.813556 O\n0.857031 0.197711 0.652030 O\n0.085591 0.803178 0.016083 O\n0.166766 0.043049 0.453002 O\n0.414409 0.803178 0.516083 O\n0.891455 0.006759 0.846520 O\n0.642969 0.197711 0.152030 O\n0.608545 0.006759 0.346520 O\n0.414409 0.303178 0.983917 O\n0.085591 0.303178 0.483917 O\n0.666766 0.456951 0.453002 O\n0.666766 0.956951 0.046998 O\n0.608545 0.506759 0.153480 O\n0.914409 0.696822 0.516083 O\n0.914409 0.196822 0.983917 O\n0.585591 0.696822 0.016083 O\n0.891455 0.506759 0.653480 O\n0.857031 0.697711 0.847970 O\n0.357031 0.302289 0.652030 O\n0.108545 0.493241 0.346520 O\n0.391455 0.493241 0.846520 O\n0.295342 0.202572 0.313556 O\n0.391455 0.993241 0.653480 O\n0.295342 0.702572 0.186444 O\n",
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],
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"volume": 917.2971356160217,
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"formula_full": "Zn8 Co8 Bi8 O40",
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"updated_at": "2021-11-28T01:35:14.220000Z",
"spacegroup": 61
},
{
"id": "mp-1042724",
"created_at": "2022-09-04T14:45:07.689089Z",
"structure_string": "Ca1 Cu3 Bi4 O12\n1.0\n-4.108186 4.108186 4.108186\n4.108186 -4.108186 4.108186\n4.108186 4.108186 -4.108186\nCa Cu Bi O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.500000 Bi\n0.000000 0.500000 0.000000 Bi\n0.000000 0.000000 0.500000 Bi\n0.500000 0.000000 0.000000 Bi\n0.319162 0.846510 0.165672 O\n0.680838 0.153490 0.834328 O\n0.680838 0.846510 0.527349 O\n0.834328 0.680838 0.153490 O\n0.846510 0.165672 0.319162 O\n0.153490 0.472651 0.319162 O\n0.472651 0.319162 0.153490 O\n0.153490 0.834328 0.680838 O\n0.319162 0.153490 0.472651 O\n0.165672 0.319162 0.846510 O\n0.846510 0.527349 0.680838 O\n0.527349 0.680838 0.846510 O\n",
"nsites": 20,
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"elements": [
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],
"chemical_system": "Bi-Ca-Cu-O",
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"formula_full": "Ca1 Cu3 Bi4 O12",
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},
{
"id": "mp-1042722",
"created_at": "2022-09-04T14:39:10.830157Z",
"structure_string": "Mg4 Co4 As8 O28\n1.0\n8.651916 0.000000 0.000000\n0.000000 7.310302 0.000000\n0.000000 3.928843 8.875255\nMg Co As O\n4 4 8 28\ndirect\n0.078547 0.724394 0.895022 Mg\n0.578547 0.275606 0.604978 Mg\n0.921453 0.275606 0.104978 Mg\n0.421453 0.724394 0.395022 Mg\n0.945997 0.180531 0.684077 Co\n0.445997 0.819469 0.815923 Co\n0.054003 0.819469 0.315923 Co\n0.554003 0.180531 0.184077 Co\n0.773145 0.567036 0.749492 As\n0.273145 0.432964 0.750508 As\n0.226855 0.432964 0.250508 As\n0.726855 0.567036 0.249492 As\n0.721871 0.984019 0.957948 As\n0.221871 0.015981 0.542052 As\n0.278129 0.015981 0.042052 As\n0.778129 0.984019 0.457948 As\n0.729554 0.142484 0.048191 O\n0.229554 0.857516 0.451809 O\n0.270446 0.857516 0.951809 O\n0.770446 0.142484 0.548191 O\n0.595728 0.652934 0.763617 O\n0.095728 0.347066 0.736383 O\n0.404272 0.347066 0.236383 O\n0.904272 0.652934 0.263617 O\n0.900049 0.536269 0.892206 O\n0.400049 0.463731 0.607794 O\n0.099951 0.463731 0.107794 O\n0.599951 0.536269 0.392206 O\n0.858122 0.749824 0.580740 O\n0.358122 0.250176 0.919260 O\n0.141878 0.250176 0.419260 O\n0.641878 0.749824 0.080740 O\n0.918425 0.038711 0.322936 O\n0.418425 0.961289 0.177064 O\n0.081575 0.961289 0.677064 O\n0.581575 0.038711 0.822936 O\n0.736259 0.364145 0.204935 O\n0.236259 0.635855 0.295065 O\n0.263741 0.635855 0.795065 O\n0.763741 0.364145 0.704935 O\n0.601700 0.953058 0.391540 O\n0.101700 0.046942 0.108460 O\n0.398300 0.046942 0.608460 O\n0.898300 0.953058 0.891540 O\n",
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"elements": [
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],
"chemical_system": "As-Co-Mg-O",
"density": 4.083164671319072,
"density_atomic": 0.07838342271787671,
"volume": 561.3431829631628,
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"formula_full": "Mg4 Co4 As8 O28",
"formula_reduced": "MgCoAs2O7",
"formula_anonymous": "ABC2D7",
"energy": -295.57804551000004,
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},
{
"id": "mp-1042715",
"created_at": "2022-09-04T14:40:03.574074Z",
"structure_string": "Mg3 Ta6 Fe4 O24\n1.0\n7.038000 0.000000 0.000000\n-1.799121 8.062526 0.000000\n-2.340977 -3.460061 9.354780\nMg Ta Fe O\n3 6 4 24\ndirect\n0.000000 0.500000 0.500000 Mg\n0.277400 0.277727 0.793007 Mg\n0.722600 0.722273 0.206993 Mg\n0.777810 0.326818 0.726601 Ta\n0.222190 0.673182 0.273399 Ta\n0.895229 0.913274 0.669865 Ta\n0.407427 0.730989 0.879464 Ta\n0.104771 0.086726 0.330135 Ta\n0.592573 0.269011 0.120536 Ta\n0.379190 0.952582 0.608204 Fe\n0.620810 0.047418 0.391796 Fe\n0.043849 0.207577 0.013028 Fe\n0.956151 0.792423 0.986972 Fe\n0.876060 0.685260 0.580855 O\n0.123940 0.314740 0.419145 O\n0.271558 0.500260 0.758389 O\n0.728442 0.499740 0.241611 O\n0.786078 0.302025 0.538364 O\n0.213922 0.697975 0.461636 O\n0.663566 0.977102 0.578378 O\n0.336434 0.022898 0.421622 O\n0.658640 0.747118 0.010598 O\n0.341360 0.252882 0.989402 O\n0.486375 0.777227 0.273017 O\n0.513625 0.222773 0.726983 O\n0.140461 0.028760 0.646688 O\n0.071809 0.062774 0.136865 O\n0.928191 0.937226 0.863135 O\n0.561912 0.134705 0.237648 O\n0.438088 0.865295 0.762352 O\n0.161273 0.440526 0.165955 O\n0.838727 0.559474 0.834045 O\n0.981902 0.241090 0.818448 O\n0.018098 0.758910 0.181552 O\n0.232144 0.793262 0.979899 O\n0.767856 0.206738 0.020101 O\n0.859539 0.971240 0.353312 O\n",
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"elements": [
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],
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"density": 5.5243085659335405,
"density_atomic": 0.06970240367549746,
"volume": 530.8281787849827,
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"formula_full": "Mg3 Ta6 Fe4 O24",
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"energy": -332.07010703,
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"spacegroup": 2
},
{
"id": "mp-1042711",
"created_at": "2022-09-04T14:41:34.608255Z",
"structure_string": "Ca8 Fe8 Bi8 O40\n1.0\n5.593882 0.000000 0.000000\n0.000000 11.383833 0.000000\n0.000000 0.000000 15.397352\nCa Fe Bi O\n8 8 8 40\ndirect\n0.506201 0.359460 0.449383 Ca\n0.006201 0.140540 0.449383 Ca\n0.006201 0.640540 0.050617 Ca\n0.993799 0.359460 0.949383 Ca\n0.493799 0.140540 0.949383 Ca\n0.993799 0.859460 0.550617 Ca\n0.493799 0.640540 0.550617 Ca\n0.506201 0.859460 0.050617 Ca\n0.977374 0.402672 0.597103 Fe\n0.522626 0.902672 0.402897 Fe\n0.022626 0.597328 0.402897 Fe\n0.477374 0.097328 0.597103 Fe\n0.022626 0.097328 0.097103 Fe\n0.977374 0.902672 0.902897 Fe\n0.522626 0.402672 0.097103 Fe\n0.477374 0.597328 0.902897 Fe\n0.948895 0.845120 0.231402 Bi\n0.051105 0.154880 0.768598 Bi\n0.551105 0.345120 0.768598 Bi\n0.051105 0.654880 0.731402 Bi\n0.448895 0.154880 0.268598 Bi\n0.448895 0.654880 0.231402 Bi\n0.551105 0.845120 0.731402 Bi\n0.948895 0.345120 0.268598 Bi\n0.919670 0.321754 0.697491 O\n0.310279 0.045456 0.073921 O\n0.189721 0.545456 0.926079 O\n0.240532 0.768710 0.150690 O\n0.259468 0.268710 0.849310 O\n0.919670 0.821754 0.802509 O\n0.259468 0.768710 0.650690 O\n0.580330 0.821754 0.302509 O\n0.310279 0.545456 0.426079 O\n0.080330 0.678246 0.302509 O\n0.580330 0.321754 0.197491 O\n0.642690 0.182001 0.524459 O\n0.810279 0.954544 0.426079 O\n0.759468 0.731290 0.650690 O\n0.170079 0.026368 0.872735 O\n0.810279 0.454544 0.073921 O\n0.080330 0.178246 0.197491 O\n0.740532 0.231290 0.349310 O\n0.142690 0.817999 0.975541 O\n0.189721 0.045456 0.573921 O\n0.357310 0.817999 0.475541 O\n0.829921 0.973632 0.127265 O\n0.759468 0.231290 0.849310 O\n0.670079 0.973632 0.627265 O\n0.357310 0.317999 0.024459 O\n0.142690 0.317999 0.524459 O\n0.689721 0.454544 0.573921 O\n0.689721 0.954544 0.926079 O\n0.670079 0.473632 0.872735 O\n0.857310 0.682001 0.475541 O\n0.857310 0.182001 0.024459 O\n0.642690 0.682001 0.975541 O\n0.829921 0.473632 0.372735 O\n0.740532 0.731290 0.150690 O\n0.240532 0.268710 0.349310 O\n0.170079 0.526368 0.627265 O\n0.329921 0.526368 0.127265 O\n0.419670 0.178246 0.697491 O\n0.329921 0.026368 0.372735 O\n0.419670 0.678246 0.802509 O\n",
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"formula_full": "Ca8 Fe8 Bi8 O40",
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"spacegroup": 61
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{
"id": "mp-1042710",
"created_at": "2022-09-04T14:44:20.340520Z",
"structure_string": "Mg2 Cr8 O12\n1.0\n1.499172 -5.066281 0.000000\n1.499172 5.066281 0.000000\n0.000000 0.000000 15.242716\nMg Cr O\n2 8 12\ndirect\n0.340943 0.659057 0.750000 Mg\n0.659057 0.340943 0.250000 Mg\n0.136317 0.863683 0.045781 Cr\n0.594802 0.405198 0.636485 Cr\n0.863683 0.136317 0.954219 Cr\n0.405198 0.594802 0.363515 Cr\n0.136317 0.863683 0.454219 Cr\n0.863683 0.136317 0.545781 Cr\n0.405198 0.594802 0.136485 Cr\n0.594802 0.405198 0.863515 Cr\n0.500000 0.500000 0.500000 O\n0.500000 0.500000 0.000000 O\n0.958451 0.041549 0.838192 O\n0.041549 0.958451 0.161808 O\n0.041549 0.958451 0.338192 O\n0.958451 0.041549 0.661808 O\n0.213485 0.786515 0.918046 O\n0.786515 0.213485 0.081954 O\n0.786515 0.213485 0.418046 O\n0.213485 0.786515 0.581954 O\n0.698581 0.301419 0.750000 O\n0.301419 0.698581 0.250000 O\n",
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{
"id": "mp-1042707",
"created_at": "2022-09-04T14:46:54.261337Z",
"structure_string": "Mg4 V6 O16\n1.0\n2.953666 -5.115900 0.000000\n2.953666 5.115900 0.000000\n0.000000 0.000000 9.521687\nMg V O\n4 6 16\ndirect\n0.666667 0.333333 0.020590 Mg\n0.333333 0.666667 0.520590 Mg\n0.666667 0.333333 0.421494 Mg\n0.333333 0.666667 0.921494 Mg\n0.674876 0.837438 0.243762 V\n0.837438 0.162562 0.743762 V\n0.162562 0.325124 0.243762 V\n0.837438 0.674876 0.743762 V\n0.325124 0.162562 0.743762 V\n0.162562 0.837438 0.243762 V\n0.835238 0.164762 0.147722 O\n0.670476 0.835238 0.647722 O\n0.164762 0.329524 0.647722 O\n0.835238 0.670476 0.147722 O\n0.329524 0.164762 0.147722 O\n0.164762 0.835238 0.647722 O\n0.517960 0.482040 0.863725 O\n0.035919 0.517960 0.363725 O\n0.482040 0.964081 0.363725 O\n0.517960 0.035919 0.863725 O\n0.000000 0.000000 0.354174 O\n0.000000 0.000000 0.854174 O\n0.333333 0.666667 0.131618 O\n0.964081 0.482040 0.863725 O\n0.482040 0.517960 0.363725 O\n0.666667 0.333333 0.631618 O\n",
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"formula_full": "Mg4 V6 O16",
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{
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"structure_string": "Ca2 Mn8 O12\n1.0\n3.161064 -0.002549 -0.000047\n-1.584702 5.170973 0.000242\n-0.000231 0.000658 15.608552\nCa Mn O\n2 8 12\ndirect\n0.661702 0.323592 0.749981 Ca\n0.338288 0.676397 0.250018 Ca\n0.862950 0.725903 0.043044 Mn\n0.408017 0.816185 0.635394 Mn\n0.137041 0.274093 0.956954 Mn\n0.591986 0.183823 0.364609 Mn\n0.863059 0.725915 0.456932 Mn\n0.136964 0.274083 0.543071 Mn\n0.591894 0.183805 0.135385 Mn\n0.408118 0.816217 0.864611 Mn\n0.499994 0.999998 0.499999 O\n0.500006 0.000001 0.000001 O\n0.051374 0.103193 0.846954 O\n0.948627 0.896803 0.153045 O\n0.948653 0.896887 0.346872 O\n0.051335 0.103112 0.653129 O\n0.777894 0.556199 0.926397 O\n0.222090 0.443799 0.073601 O\n0.222118 0.443762 0.426331 O\n0.777887 0.556239 0.573670 O\n0.321534 0.643038 0.750008 O\n0.678458 0.356955 0.249993 O\n",
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"elements": [
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"Mn",
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],
"chemical_system": "Ca-Mn-O",
"density": 4.632939650477331,
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"volume": 255.07085418813674,
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"formula_full": "Ca2 Mn8 O12",
"formula_reduced": "CaMn4O6",
"formula_anonymous": "AB4C6",
"energy": -185.80318975,
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"updated_at": "2021-11-28T01:35:48.038000Z",
"spacegroup": 63
},
{
"id": "mp-1042703",
"created_at": "2022-09-04T14:39:22.525131Z",
"structure_string": "Ca1 Cu3 Sb4 O12\n1.0\n-3.913976 3.913976 3.913976\n3.913976 -3.913976 3.913976\n3.913976 3.913976 -3.913976\nCa Cu Sb O\n1 3 4 12\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.000000 Cu\n0.500000 0.000000 0.500000 Cu\n0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.500000 Sb\n0.000000 0.500000 0.000000 Sb\n0.000000 0.000000 0.500000 Sb\n0.500000 0.000000 0.000000 Sb\n0.300819 0.825181 0.126000 O\n0.699181 0.174819 0.874000 O\n0.699181 0.825181 0.524362 O\n0.874000 0.699181 0.174819 O\n0.825181 0.126000 0.300819 O\n0.174819 0.475638 0.300819 O\n0.475638 0.300819 0.174819 O\n0.174819 0.874000 0.699181 O\n0.300819 0.174819 0.475638 O\n0.126000 0.300819 0.825181 O\n0.825181 0.524362 0.699181 O\n0.524362 0.699181 0.825181 O\n",
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],
"chemical_system": "Ca-Cu-O-Sb",
"density": 6.298775399893222,
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"volume": 239.83605181700548,
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"formula_full": "Ca1 Cu3 Sb4 O12",
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"updated_at": "2021-11-28T01:34:37.211000Z",
"spacegroup": 204
},
{
"id": "mp-1042702",
"created_at": "2022-09-04T14:47:15.392589Z",
"structure_string": "Sr4 Y2 Cu4 Ni2 O14\n1.0\n-2.712889 2.758960 11.550920\n2.712889 -2.758960 11.550920\n2.712889 2.758960 -11.550920\nSr Y Cu Ni O\n4 2 4 2 14\ndirect\n0.663563 0.664595 0.022963 Sr\n0.336437 0.359399 0.001032 Sr\n0.141633 0.164595 0.001032 Sr\n0.858367 0.859399 0.022963 Sr\n0.000000 0.009976 0.009976 Y\n0.500000 0.509976 0.009976 Y\n0.570743 0.084116 0.509948 Cu\n0.429257 0.939205 0.513373 Cu\n0.074168 0.584116 0.513373 Cu\n0.925832 0.439205 0.509948 Cu\n0.320241 0.722246 0.542488 Ni\n0.679759 0.222246 0.402005 Ni\n0.634376 0.869692 0.004067 O\n0.365624 0.369692 0.235316 O\n0.805329 0.818512 0.500575 O\n0.194671 0.695246 0.013183 O\n0.817937 0.318512 0.013183 O\n0.182063 0.195246 0.500575 O\n0.317708 0.329510 0.519007 O\n0.682292 0.201299 0.011803 O\n0.310503 0.829510 0.011803 O\n0.689497 0.701299 0.519007 O\n0.133772 0.708999 0.491664 O\n0.866228 0.357893 0.575227 O\n0.717335 0.208999 0.575227 O\n0.282665 0.857893 0.491664 O\n",
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"elements": [
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],
"chemical_system": "Cu-Ni-O-Sr-Y",
"density": 5.396411209963755,
"density_atomic": 0.0751829481983765,
"volume": 345.82309716555443,
"volume_molar": 8.009982189192792,
"formula_full": "Sr4 Y2 Cu4 Ni2 O14",
"formula_reduced": "Sr2YCu2NiO7",
"formula_anonymous": "ABC2D2E7",
"energy": -173.97120887,
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"updated_at": "2021-11-28T01:38:03.223000Z",
"spacegroup": 46
},
{
"id": "mp-1042698",
"created_at": "2022-09-04T14:47:08.013623Z",
"structure_string": "Zn8 Bi8 Mo8 O40\n1.0\n5.310685 0.000000 0.000000\n0.000000 10.482866 0.000000\n0.000000 0.000000 16.058382\nZn Bi Mo O\n8 8 8 40\ndirect\n0.539295 0.376142 0.562370 Zn\n0.039295 0.123858 0.562370 Zn\n0.039295 0.623858 0.937630 Zn\n0.960705 0.376142 0.062370 Zn\n0.460705 0.123858 0.062370 Zn\n0.960705 0.876142 0.437630 Zn\n0.460705 0.623858 0.437630 Zn\n0.539295 0.876142 0.937630 Zn\n0.998929 0.858718 0.776371 Bi\n0.001071 0.141282 0.223629 Bi\n0.501071 0.358718 0.223629 Bi\n0.001071 0.641282 0.276371 Bi\n0.498929 0.141282 0.723629 Bi\n0.498929 0.641282 0.776371 Bi\n0.501071 0.858718 0.276371 Bi\n0.998929 0.358718 0.723629 Bi\n0.982667 0.375848 0.415988 Mo\n0.517333 0.875848 0.584012 Mo\n0.017333 0.624152 0.584012 Mo\n0.482667 0.124152 0.415988 Mo\n0.017333 0.124152 0.915988 Mo\n0.982667 0.875848 0.084012 Mo\n0.517333 0.375848 0.915988 Mo\n0.482667 0.624152 0.084012 Mo\n0.886296 0.326985 0.305445 O\n0.278474 0.026489 0.956983 O\n0.221526 0.526489 0.043017 O\n0.323147 0.787032 0.851726 O\n0.176853 0.287032 0.148274 O\n0.886296 0.826985 0.194555 O\n0.176853 0.787032 0.351726 O\n0.613704 0.826985 0.694555 O\n0.278474 0.526489 0.543017 O\n0.113704 0.673015 0.694555 O\n0.613704 0.326985 0.805445 O\n0.726396 0.224727 0.469044 O\n0.778474 0.973511 0.543017 O\n0.676853 0.712968 0.351726 O\n0.195592 0.014991 0.126830 O\n0.778474 0.473511 0.956983 O\n0.113704 0.173015 0.805445 O\n0.823147 0.212968 0.648274 O\n0.226396 0.775273 0.030956 O\n0.221526 0.026489 0.456983 O\n0.273604 0.775273 0.530956 O\n0.804408 0.985009 0.873170 O\n0.676853 0.212968 0.148274 O\n0.695592 0.985009 0.373170 O\n0.273604 0.275273 0.969044 O\n0.226396 0.275273 0.469044 O\n0.721526 0.473511 0.456983 O\n0.721526 0.973511 0.043017 O\n0.695592 0.485009 0.126830 O\n0.773604 0.724727 0.530956 O\n0.773604 0.224727 0.969044 O\n0.726396 0.724727 0.030956 O\n0.804408 0.485009 0.626830 O\n0.823147 0.712968 0.851726 O\n0.323147 0.287032 0.648274 O\n0.195592 0.514991 0.373170 O\n0.304408 0.514991 0.873170 O\n0.386296 0.173015 0.305445 O\n0.304408 0.014991 0.626830 O\n0.386296 0.673015 0.194555 O\n",
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],
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"formula_full": "Zn8 Bi8 Mo8 O40",
"formula_reduced": "ZnBiMoO5",
"formula_anonymous": "ABCD5",
"energy": -437.71248389,
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"updated_at": "2021-11-28T01:37:57.204000Z",
"spacegroup": 61
},
{
"id": "mp-1042696",
"created_at": "2022-09-04T14:45:32.153816Z",
"structure_string": "Zn8 Cr8 Bi8 O40\n1.0\n5.314387 0.000000 0.000000\n0.000000 10.723208 0.000000\n0.000000 0.000000 15.266191\nZn Cr Bi O\n8 8 8 40\ndirect\n0.499840 0.358963 0.451314 Zn\n0.999840 0.141037 0.451314 Zn\n0.999840 0.641037 0.048686 Zn\n0.000160 0.358963 0.951314 Zn\n0.500160 0.141037 0.951314 Zn\n0.000160 0.858963 0.548686 Zn\n0.500160 0.641037 0.548686 Zn\n0.499840 0.858963 0.048686 Zn\n0.972708 0.397425 0.590484 Cr\n0.527292 0.897425 0.409516 Cr\n0.027292 0.602575 0.409516 Cr\n0.472708 0.102575 0.590484 Cr\n0.027292 0.102575 0.090484 Cr\n0.972708 0.897425 0.909516 Cr\n0.527292 0.397425 0.090484 Cr\n0.472708 0.602575 0.909516 Cr\n0.976138 0.854361 0.227966 Bi\n0.023862 0.145639 0.772034 Bi\n0.523862 0.354361 0.772034 Bi\n0.023862 0.645639 0.727966 Bi\n0.476138 0.145639 0.272034 Bi\n0.476138 0.645639 0.227966 Bi\n0.523862 0.854361 0.727966 Bi\n0.976138 0.354361 0.272034 Bi\n0.924832 0.332933 0.696319 O\n0.312480 0.041968 0.056766 O\n0.187520 0.541968 0.943234 O\n0.284727 0.778634 0.145048 O\n0.215273 0.278634 0.854952 O\n0.924832 0.832933 0.803681 O\n0.215273 0.778634 0.645048 O\n0.575168 0.832933 0.303681 O\n0.312480 0.541968 0.443234 O\n0.075168 0.667067 0.303681 O\n0.575168 0.332933 0.196319 O\n0.642773 0.200383 0.526490 O\n0.812480 0.958032 0.443234 O\n0.715273 0.721366 0.645048 O\n0.171795 0.023591 0.882540 O\n0.812480 0.458032 0.056766 O\n0.075168 0.167067 0.196319 O\n0.784727 0.221366 0.354952 O\n0.142773 0.799617 0.973510 O\n0.187520 0.041968 0.556766 O\n0.357227 0.799617 0.473510 O\n0.828205 0.976409 0.117460 O\n0.715273 0.221366 0.854952 O\n0.671795 0.976409 0.617460 O\n0.357227 0.299617 0.026490 O\n0.142773 0.299617 0.526490 O\n0.687520 0.458032 0.556766 O\n0.687520 0.958032 0.943234 O\n0.671795 0.476409 0.882540 O\n0.857227 0.700383 0.473510 O\n0.857227 0.200383 0.026490 O\n0.642773 0.700383 0.973510 O\n0.828205 0.476409 0.382540 O\n0.784727 0.721366 0.145048 O\n0.284727 0.278634 0.354952 O\n0.171795 0.523591 0.617460 O\n0.328205 0.523591 0.117460 O\n0.424832 0.167067 0.696319 O\n0.328205 0.023591 0.382540 O\n0.424832 0.667067 0.803681 O\n",
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],
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"volume": 869.9786582058538,
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"formula_full": "Zn8 Cr8 Bi8 O40",
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"updated_at": "2021-11-28T01:37:04.353000Z",
"spacegroup": 61
}
]
}