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{
"id": "jvasp-66451",
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"structure_string": "Ba4 Si1 Sb1\n1.0\n0.000000 4.887363 4.887363\n4.887363 0.000000 4.887363\n4.887363 4.887363 -0.000000\nBa Si Sb\n4 1 1\ndirect\n0.125732 0.624755 0.624755 Ba\n0.624755 0.624755 0.624755 Ba\n0.624755 0.125732 0.624755 Ba\n0.624755 0.624755 0.125732 Ba\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 Sb\n",
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{
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"structure_string": "Mn4 Be1 Sb1\n1.0\n0.000000 3.359285 3.359285\n3.359285 -0.000000 3.359285\n3.359285 3.359285 0.000000\nMn Be Sb\n4 1 1\ndirect\n0.121797 0.626067 0.626067 Mn\n0.626067 0.626067 0.626067 Mn\n0.626067 0.121797 0.626067 Mn\n0.626067 0.626067 0.121797 Mn\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Sb\n",
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{
"id": "jvasp-65055",
"created_at": "2022-09-04T14:35:47.435821Z",
"updated_at": "2022-09-04T14:35:47.435842Z",
"structure_string": "Be1 Ir4 Pd1\n1.0\n0.000000 3.630775 3.630775\n3.630775 0.000000 3.630775\n3.630775 3.630775 -0.000000\nBe Ir Pd\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.124367 0.625212 0.625212 Ir\n0.625212 0.625212 0.625212 Ir\n0.625212 0.124367 0.625212 Ir\n0.625212 0.625212 0.124367 Ir\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 6,
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"elements": [
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"volume": 95.72557966754346,
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"formula_full": "Be1 Ir4 Pd1",
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{
"id": "jvasp-66527",
"created_at": "2022-09-04T14:35:45.434011Z",
"updated_at": "2022-09-04T14:35:45.434036Z",
"structure_string": "Ba4 Zn1 Re1\n1.0\n-0.000000 4.759682 4.759682\n4.759682 0.000000 4.759682\n4.759682 4.759682 0.000000\nBa Zn Re\n4 1 1\ndirect\n0.127473 0.624175 0.624175 Ba\n0.624175 0.624175 0.624175 Ba\n0.624175 0.127473 0.624175 Ba\n0.624175 0.624175 0.127473 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Re\n",
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"formula_full": "Ba4 Zn1 Re1",
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{
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"created_at": "2022-09-04T14:35:41.652664Z",
"updated_at": "2022-09-04T14:35:41.652693Z",
"structure_string": "Pr1 In1 Pt4\n1.0\n-3.865806 -3.865806 -0.000000\n-3.865806 0.000000 -3.865806\n-0.000000 -3.865806 -3.865806\nPr In Pt\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Pr\n0.750001 0.750001 0.750001 In\n0.873289 0.375571 0.375571 Pt\n0.375571 0.873289 0.375571 Pt\n0.375571 0.375571 0.873289 Pt\n0.375571 0.375571 0.375571 Pt\n",
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{
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"created_at": "2022-09-04T14:35:42.408825Z",
"updated_at": "2022-09-04T14:35:42.408839Z",
"structure_string": "Li4 Mn4 F16\n1.0\n4.563815 0.000000 0.000000\n-0.000000 5.806088 0.000000\n0.000000 0.000000 9.984321\nLi Mn F\n4 4 16\ndirect\n0.500001 0.000000 0.000000 Li\n0.500001 0.500000 0.000000 Li\n0.000000 0.000000 0.500000 Li\n0.000000 0.500000 0.500000 Li\n0.975613 0.750000 0.239685 Mn\n0.475612 0.250000 0.260314 Mn\n0.524389 0.750000 0.739685 Mn\n0.024389 0.250000 0.760314 Mn\n0.761815 0.498915 0.827691 F\n0.319938 0.750000 0.901407 F\n0.819938 0.250000 0.598593 F\n0.261814 0.501085 0.672309 F\n0.261814 0.998915 0.672309 F\n0.751709 0.750000 0.587329 F\n0.248292 0.250000 0.412671 F\n0.680064 0.250000 0.098593 F\n0.738187 0.498915 0.327691 F\n0.180063 0.750000 0.401407 F\n0.761815 0.001085 0.827691 F\n0.238186 0.501085 0.172309 F\n0.238186 0.998915 0.172309 F\n0.748293 0.750000 0.087329 F\n0.738187 0.001085 0.327691 F\n0.251708 0.250000 0.912671 F\n",
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{
"id": "jvasp-64719",
"created_at": "2022-09-04T14:35:41.662543Z",
"updated_at": "2022-09-04T14:35:41.662569Z",
"structure_string": "Ba4 Y1 Nb1\n1.0\n-0.000000 5.037542 5.037542\n5.037542 -0.000000 5.037542\n5.037542 5.037542 -0.000000\nBa Y Nb\n4 1 1\ndirect\n0.126484 0.624505 0.624505 Ba\n0.624505 0.624505 0.624505 Ba\n0.624505 0.126484 0.624505 Ba\n0.624505 0.624505 0.126484 Ba\n0.000000 0.000000 0.000000 Y\n0.250000 0.250000 0.250000 Nb\n",
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"spacegroup": 216
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{
"id": "jvasp-65297",
"created_at": "2022-09-04T14:35:45.413903Z",
"updated_at": "2022-09-04T14:35:45.413920Z",
"structure_string": "Be1 Zn1 Ge4\n1.0\n0.000000 3.884288 3.884288\n3.884288 0.000000 3.884288\n3.884288 3.884288 0.000000\nBe Zn Ge\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.250000 0.250000 Zn\n0.123978 0.625341 0.625341 Ge\n0.625341 0.625341 0.625341 Ge\n0.625341 0.123978 0.625341 Ge\n0.625341 0.625341 0.123978 Ge\n",
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},
{
"id": "jvasp-66132",
"created_at": "2022-09-04T14:35:45.412811Z",
"updated_at": "2022-09-04T14:35:45.412841Z",
"structure_string": "Ba4 Co1 P1\n1.0\n-0.000000 4.780285 4.780285\n4.780285 -0.000000 4.780285\n4.780285 4.780285 -0.000000\nBa Co P\n4 1 1\ndirect\n0.123867 0.625377 0.625377 Ba\n0.625377 0.625377 0.625377 Ba\n0.625377 0.123867 0.625377 Ba\n0.625377 0.625377 0.123867 Ba\n0.250000 0.250000 0.250000 Co\n0.000000 0.000000 0.000000 P\n",
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{
"id": "jvasp-66569",
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"structure_string": "Ba4 Ge1 Ru1\n1.0\n-0.000000 4.783959 4.783959\n4.783959 -0.000000 4.783959\n4.783959 4.783959 -0.000000\nBa Ge Ru\n4 1 1\ndirect\n0.125173 0.624942 0.624942 Ba\n0.624942 0.624942 0.624942 Ba\n0.624942 0.125173 0.624942 Ba\n0.624942 0.624942 0.125173 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Ru\n",
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{
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"created_at": "2022-09-04T14:35:40.767467Z",
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