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{
"id": "jvasp-38821",
"created_at": "2022-09-04T14:38:03.512092Z",
"updated_at": "2022-09-04T14:38:03.512112Z",
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{
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{
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"volume": 61.82977128669998,
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{
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"updated_at": "2022-09-04T14:37:35.384983Z",
"structure_string": "Zn2 Rh1 Au1\n1.0\n0.000001 3.093194 3.093201\n3.093195 0.000003 3.093199\n3.093198 3.093195 0.000000\nZn Rh Au\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500002 0.500000 Zn\n0.749999 0.750000 0.749997 Rh\n0.250000 0.250000 0.249999 Au\n",
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"formula_full": "Zn2 Rh1 Au1",
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"spacegroup": 225
},
{
"id": "jvasp-9703",
"created_at": "2022-09-04T14:37:10.366980Z",
"updated_at": "2022-09-04T14:37:10.367007Z",
"structure_string": "Zn2 Rh4 O8\n1.0\n5.261725 0.000000 3.037858\n1.753908 4.960802 3.037858\n0.000000 0.000000 6.075716\nZn Rh O\n2 4 8\ndirect\n0.875001 0.875000 0.875001 Zn\n0.125000 0.125000 0.125000 Zn\n0.500001 0.500000 0.000000 Rh\n0.500001 0.500000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 -0.000000 0.500000 Rh\n0.739492 0.739491 0.739492 O\n0.260509 0.260509 0.718476 O\n0.260509 0.718475 0.260509 O\n0.718476 0.260509 0.260509 O\n0.739492 0.281525 0.739492 O\n0.281526 0.739491 0.739492 O\n0.260509 0.260509 0.260509 O\n0.739492 0.739491 0.281525 O\n",
"nsites": 14,
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"density": 7.019859186903128,
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"volume": 158.59062291460563,
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"formula_full": "Zn2 Rh4 O8",
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"formula_anonymous": "AB2C4",
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"spacegroup": 227
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{
"id": "jvasp-114385",
"created_at": "2022-09-04T14:38:40.527191Z",
"updated_at": "2022-09-04T14:38:40.527222Z",
"structure_string": "Zn2 S1 O2\n1.0\n3.299972 0.000000 0.000000\n-1.649986 2.857859 0.000000\n0.000000 0.000000 7.504476\nZn S O\n2 1 2\ndirect\n0.666667 0.333334 0.331366 Zn\n0.333334 0.666667 0.668634 Zn\n0.000000 0.000000 0.000000 S\n0.333334 0.666667 0.353792 O\n0.666667 0.333334 0.646208 O\n",
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"elements": [
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"formula_full": "Zn2 S1 O2",
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{
"id": "jvasp-22618",
"created_at": "2022-09-04T14:38:11.755203Z",
"updated_at": "2022-09-04T14:38:11.755219Z",
"structure_string": "Zn2 S2\n1.0\n3.834978 0.000000 0.000000\n-1.917489 3.321189 0.000000\n0.000000 0.000000 6.303831\nZn S\n2 2\ndirect\n0.333333 0.666667 0.000611 Zn\n0.666667 0.333333 0.500610 Zn\n0.333333 0.666667 0.374389 S\n0.666667 0.333333 0.874389 S\n",
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"spacegroup": 186
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{
"id": "jvasp-11321",
"created_at": "2022-09-04T14:37:08.622703Z",
"updated_at": "2022-09-04T14:37:08.622729Z",
"structure_string": "Zn2 Sb2 F10\n1.0\n5.152903 0.191607 1.218077\n-1.392738 4.788259 0.695479\n0.057869 -1.292264 7.943801\nZn Sb F\n2 2 10\ndirect\n0.383976 0.556674 0.222189 Zn\n0.732943 0.574151 0.781469 Zn\n0.043074 0.082920 0.013871 Sb\n0.480314 0.073090 0.513767 Sb\n0.070883 0.840476 0.788995 F\n0.784009 -0.022596 0.344810 F\n0.605787 0.875664 0.686250 F\n0.817612 0.256634 0.901831 F\n0.350623 0.325761 0.841998 F\n0.785119 0.394133 0.557653 F\n0.635367 0.741073 0.026926 F\n0.320395 0.657863 0.454872 F\n0.059451 0.481541 0.135327 F\n0.416601 0.178632 0.232096 F\n",
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"density": 4.579732090462092,
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"volume": 204.61432279645524,
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"formula_full": "Zn2 Sb2 F10",
"formula_reduced": "ZnSbF5",
"formula_anonymous": "ABC5",
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"spacegroup": 1
},
{
"id": "jvasp-11276",
"created_at": "2022-09-04T14:38:30.692178Z",
"updated_at": "2022-09-04T14:38:30.692202Z",
"structure_string": "Zn2 Sb3 O8\n1.0\n5.136322 -0.388936 -2.326244\n-0.979502 5.821537 -3.136063\n-0.885955 -0.376276 6.702544\nZn Sb O\n2 3 8\ndirect\n0.693736 0.668688 0.337376 Zn\n0.306263 0.331312 0.662624 Zn\n0.500000 0.999999 0.000001 Sb\n0.000000 0.733311 0.000001 Sb\n0.000000 0.266690 0.000000 Sb\n0.000797 0.381816 0.763633 O\n0.999201 0.618182 0.236367 O\n0.980703 0.882711 0.765423 O\n0.019296 0.117287 0.234577 O\n0.445763 0.365932 0.217409 O\n0.445763 0.851476 0.217409 O\n0.554236 0.148522 0.782589 O\n0.554236 0.634066 0.782590 O\n",
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{
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"created_at": "2022-09-04T14:36:01.500909Z",
"updated_at": "2022-09-04T14:36:01.500923Z",
"structure_string": "Zn2 Sb4\n1.0\n0.000000 0.000000 3.232521\n6.942763 0.000000 0.000000\n0.000000 6.942763 0.000000\nZn Sb\n2 4\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Zn\n0.250000 0.353014 0.146986 Sb\n0.750000 0.146986 0.646986 Sb\n0.750000 0.853014 0.353014 Sb\n0.250000 0.646986 0.853014 Sb\n",
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},
{
"id": "jvasp-9386",
"created_at": "2022-09-04T14:38:11.959375Z",
"updated_at": "2022-09-04T14:38:11.959399Z",
"structure_string": "Zn2 Sb4 O12\n1.0\n4.728351 -0.000000 0.000000\n0.000000 4.728351 0.000000\n0.000000 0.000000 9.434769\nZn Sb O\n2 4 12\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n0.500000 0.500000 0.832389 Sb\n0.000000 0.000000 0.332388 Sb\n0.500000 0.500000 0.167612 Sb\n0.000000 0.000000 0.667612 Sb\n0.689476 0.689476 0.000000 O\n0.810523 0.189476 0.500000 O\n0.189476 0.810523 0.500000 O\n0.310523 0.310523 0.000000 O\n0.801548 0.198452 0.827468 O\n0.698452 0.698452 0.327468 O\n0.198452 0.801548 0.172532 O\n0.301548 0.301548 0.327468 O\n0.301548 0.301548 0.672532 O\n0.698452 0.698452 0.672532 O\n0.801548 0.198452 0.172532 O\n0.198452 0.801548 0.827468 O\n",
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"formula_full": "Zn2 Sb4 O12",
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},
{
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"created_at": "2022-09-04T14:37:27.913988Z",
"updated_at": "2022-09-04T14:37:27.914016Z",
"structure_string": "Zn2 Sb4 O12\n1.0\n5.204190 0.000318 0.000205\n-0.000331 5.428520 0.000769\n-0.000292 -0.000964 7.590207\nZn Sb O\n2 4 12\ndirect\n0.477318 0.437628 0.249985 Zn\n0.977319 0.062368 0.749985 Zn\n0.496624 0.995581 0.001399 Sb\n0.996626 0.504430 0.998588 Sb\n0.996623 0.504412 0.501398 Sb\n0.496625 0.995566 0.498586 Sb\n0.355454 0.961636 0.749996 O\n0.855451 0.538357 0.249994 O\n0.323811 0.681218 0.066456 O\n0.823825 0.818805 0.933534 O\n0.200721 0.209340 0.431020 O\n0.200735 0.209369 0.068981 O\n0.700718 0.290659 0.931021 O\n0.613803 0.059309 0.249994 O\n0.823813 0.818776 0.566458 O\n0.323818 0.681189 0.433532 O\n0.700738 0.290624 0.568981 O\n0.113803 0.440683 0.749995 O\n",
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}
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}