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{
"id": "jvasp-118617",
"created_at": "2022-09-04T14:38:27.583458Z",
"updated_at": "2022-09-04T14:38:27.583477Z",
"structure_string": "Li2 O1\n1.0\n2.983388 0.000000 0.000000\n0.000000 3.705797 0.000000\n0.000000 0.000000 5.261135\nLi O\n2 1\ndirect\n-0.033331 0.000000 0.810721 Li\n-0.033331 0.000000 0.189278 Li\n0.466662 0.000000 0.000000 O\n",
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{
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"structure_string": "Mg6 Co1 C1\n1.0\n5.976904 -1.254253 0.000000\n-4.074666 7.057528 0.000000\n0.000000 0.000000 3.731524\nMg Co C\n6 1 1\ndirect\n0.785602 0.392707 0.250000 Mg\n0.785601 0.892896 0.250000 Mg\n0.268739 0.063886 0.749999 Mg\n0.268739 0.704854 0.749999 Mg\n0.916107 0.208054 0.749999 Mg\n0.686682 0.593342 0.749999 Mg\n0.288246 0.394123 0.250000 Co\n0.000281 0.750140 0.250000 C\n",
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{
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"structure_string": "Li1 Be1 In1\n1.0\n-1.693542 1.693542 4.072957\n1.693542 -1.693542 4.072957\n1.693542 1.693542 -4.072957\nLi Be In\n1 1 1\ndirect\n0.659903 0.659903 0.000000 Li\n0.006175 0.006175 0.000000 Be\n0.333924 0.333924 0.000000 In\n",
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{
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"created_at": "2022-09-04T14:35:54.894329Z",
"updated_at": "2022-09-04T14:35:54.894364Z",
"structure_string": "Ca2 Sn4 Rh2\n1.0\n4.370874 0.000000 0.000000\n-2.185437 5.466193 0.000000\n0.000000 -0.000000 7.576317\nCa Sn Rh\n2 4 2\ndirect\n0.067491 0.134984 0.750000 Ca\n0.932507 0.865015 0.250000 Ca\n0.356283 0.712568 0.954046 Sn\n0.643715 0.287432 0.045954 Sn\n0.643715 0.287432 0.454046 Sn\n0.356283 0.712568 0.545954 Sn\n0.790589 0.581180 0.750000 Rh\n0.209409 0.418819 0.250000 Rh\n",
"nsites": 8,
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"density": 6.979305531372796,
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"volume": 181.0136753526323,
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"spacegroup": 63
},
{
"id": "jvasp-85865",
"created_at": "2022-09-04T14:36:08.774105Z",
"updated_at": "2022-09-04T14:36:08.774143Z",
"structure_string": "Ga4 Pd8\n1.0\n4.084088 -0.000000 0.000000\n0.000000 5.603930 0.000000\n0.000000 0.000000 7.870050\nGa Pd\n4 8\ndirect\n0.750000 0.706926 0.891538 Ga\n0.250000 0.293074 0.108462 Ga\n0.750000 0.206926 0.608462 Ga\n0.250000 0.793074 0.391538 Ga\n0.750000 0.662579 0.566525 Pd\n0.250000 0.337421 0.433475 Pd\n0.750000 0.162579 0.933475 Pd\n0.250000 0.837421 0.066525 Pd\n0.750000 0.541232 0.206092 Pd\n0.250000 0.458768 0.793908 Pd\n0.750000 0.041232 0.293908 Pd\n0.250000 0.958768 0.706092 Pd\n",
"nsites": 12,
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"elements": [
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"density": 10.419793137907611,
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"volume": 180.12138784932412,
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"formula_full": "Ga4 Pd8",
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},
{
"id": "jvasp-86364",
"created_at": "2022-09-04T14:36:12.898067Z",
"updated_at": "2022-09-04T14:36:12.898094Z",
"structure_string": "Ga4 Pd8\n1.0\n4.084069 0.000000 0.000000\n-0.000000 5.603906 0.000000\n0.000000 0.000000 7.870269\nGa Pd\n4 8\ndirect\n0.750000 0.706928 0.891539 Ga\n0.250000 0.293072 0.108461 Ga\n0.750000 0.206928 0.608461 Ga\n0.250000 0.793073 0.391539 Ga\n0.750000 0.662579 0.566526 Pd\n0.250000 0.337421 0.433474 Pd\n0.750000 0.162579 0.933474 Pd\n0.250000 0.837422 0.066526 Pd\n0.750000 0.541231 0.206091 Pd\n0.250000 0.458769 0.793909 Pd\n0.750000 0.041231 0.293909 Pd\n0.250000 0.958770 0.706091 Pd\n",
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"elements": [
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"formula_full": "Ga4 Pd8",
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{
"id": "jvasp-80240",
"created_at": "2022-09-04T14:37:16.130930Z",
"updated_at": "2022-09-04T14:37:16.130956Z",
"structure_string": "Zn1 Ga1 Pd2\n1.0\n-8.314935 0.000000 -4.800630\n-8.669455 -0.001156 5.414678\n-5.660917 8.508273 0.203739\nZn Ga Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Zn\n0.500000 -0.000000 -0.000000 Ga\n0.742007 -0.000000 -0.000000 Pd\n0.257992 -0.000000 -0.000000 Pd\n",
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"formula_anonymous": "ABC2",
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"spacegroup": 71
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{
"id": "jvasp-16490",
"created_at": "2022-09-04T14:37:56.417120Z",
"updated_at": "2022-09-04T14:37:56.417148Z",
"structure_string": "W8\n1.0\n5.081963 0.000000 0.000000\n0.000000 5.081963 -0.000000\n0.000000 -0.000000 5.081963\nW\n8\ndirect\n0.250000 0.000000 0.500000 W\n0.750000 0.000000 0.500000 W\n0.000000 0.500000 0.250000 W\n0.000000 0.500000 0.750000 W\n0.500000 0.750000 0.000000 W\n0.500000 0.250000 0.000000 W\n0.000000 0.000000 0.000000 W\n0.500000 0.500000 0.500000 W\n",
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{
"id": "jvasp-25084",
"created_at": "2022-09-04T14:37:44.226984Z",
"updated_at": "2022-09-04T14:37:44.227000Z",
"structure_string": "W8\n1.0\n5.081957 0.000000 -0.000000\n0.000000 5.081957 0.000000\n-0.000000 0.000000 5.081957\nW\n8\ndirect\n0.250000 0.000000 0.500000 W\n0.750000 0.000000 0.500000 W\n0.000000 0.500000 0.250000 W\n0.000000 0.500000 0.750000 W\n0.500000 0.750000 0.000000 W\n0.500000 0.250000 0.000000 W\n0.000000 0.000000 0.000000 W\n0.500000 0.500000 0.500000 W\n",
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},
{
"id": "jvasp-78708",
"created_at": "2022-09-04T14:37:11.783296Z",
"updated_at": "2022-09-04T14:37:11.783314Z",
"structure_string": "Cu1 Pt1\n1.0\n1.371590 0.791888 4.309004\n-1.371590 0.791888 4.309004\n0.000000 -1.583775 4.309004\nCu Pt\n1 1\ndirect\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.499998 Pt\n",
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{
"id": "jvasp-86999",
"created_at": "2022-09-04T14:35:46.138744Z",
"updated_at": "2022-09-04T14:35:46.138769Z",
"structure_string": "Ca2 Sb4\n1.0\n4.315330 0.000000 0.000000\n0.000000 4.488739 -1.199101\n0.000000 -0.100685 8.891314\nCa Sb\n2 4\ndirect\n0.250000 0.886615 0.290760 Ca\n0.750000 0.113384 0.709240 Ca\n0.250000 0.240820 0.013735 Sb\n0.750000 0.759180 0.986265 Sb\n0.250000 0.568179 0.621857 Sb\n0.750000 0.431821 0.378143 Sb\n",
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{
"id": "jvasp-114898",
"created_at": "2022-09-04T14:38:42.378510Z",
"updated_at": "2022-09-04T14:38:42.378537Z",
"structure_string": "In1 Cu1 O2\n1.0\n1.668352 0.963224 5.832756\n-1.668352 0.963224 5.832756\n-0.000000 -1.926447 5.832756\nIn Cu O\n1 1 2\ndirect\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500002 Cu\n0.394595 0.394595 0.394597 O\n0.605405 0.605405 0.605408 O\n",
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