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{
"id": "jvasp-94406",
"created_at": "2022-09-04T14:36:14.553891Z",
"updated_at": "2022-09-04T14:36:14.553917Z",
"structure_string": "Mg5 Sb1\n1.0\n5.558547 -0.000000 0.000000\n-2.779273 4.813843 -0.000000\n-0.000000 0.000000 5.258962\nMg Sb\n5 1\ndirect\n0.000000 0.663317 0.000000 Mg\n0.663317 0.000000 0.000000 Mg\n0.336683 0.336683 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.333333 0.666667 0.500000 Mg\n0.000000 0.000000 0.500000 Sb\n",
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{
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{
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"structure_string": "La1 Te1\n1.0\n3.965833 0.000000 2.289675\n1.321944 3.739023 2.289675\n0.000000 0.000000 4.579350\nLa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.499999 0.500000 0.500000 Te\n",
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{
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"updated_at": "2022-09-04T14:38:29.038241Z",
"structure_string": "Ba1 Zn1 F1\n1.0\n4.089499 0.000000 0.000000\n0.000000 4.089499 0.000000\n0.000000 0.000000 7.859337\nBa Zn F\n1 1 1\ndirect\n0.000000 0.000000 0.301851 Ba\n0.000000 0.000000 0.737459 Zn\n0.000000 0.000000 -0.001920 F\n",
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"spacegroup": 99
},
{
"id": "jvasp-86279",
"created_at": "2022-09-04T14:36:02.346597Z",
"updated_at": "2022-09-04T14:36:02.346620Z",
"structure_string": "Ca3 Si1 Br2\n1.0\n4.363838 0.064290 10.666128\n2.149699 3.798158 10.666128\n0.108418 0.064290 11.523784\nCa Si Br\n3 1 2\ndirect\n0.124154 0.124154 0.124154 Ca\n0.000000 0.000000 0.000000 Ca\n0.875847 0.875846 0.875845 Ca\n0.500000 0.500000 0.499999 Si\n0.714702 0.714702 0.714701 Br\n0.285298 0.285298 0.285298 Br\n",
"nsites": 6,
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"elements": [
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"volume": 183.57271843946148,
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{
"id": "jvasp-86881",
"created_at": "2022-09-04T14:35:49.553065Z",
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"structure_string": "Ca3 Si1 Br2\n1.0\n4.363838 0.064290 10.666128\n2.149699 3.798158 10.666128\n0.108418 0.064290 11.523784\nCa Si Br\n3 1 2\ndirect\n0.124154 0.124154 0.124154 Ca\n0.000000 0.000000 0.000000 Ca\n0.875847 0.875846 0.875845 Ca\n0.500000 0.500000 0.499999 Si\n0.714702 0.714702 0.714701 Br\n0.285298 0.285298 0.285298 Br\n",
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{
"id": "jvasp-90137",
"created_at": "2022-09-04T14:35:50.192714Z",
"updated_at": "2022-09-04T14:35:50.192745Z",
"structure_string": "Sm3 Mg3 Ag3\n1.0\n0.000000 0.000000 -4.232398\n-3.850504 -6.669268 0.000000\n-3.849360 6.668608 0.000000\nSm Mg Ag\n3 3 3\ndirect\n0.500000 0.585257 -0.000000 Sm\n0.500000 0.414699 0.414723 Sm\n0.500000 -0.000024 0.585277 Sm\n0.000000 0.242929 -0.000000 Mg\n0.000000 0.757041 0.757039 Mg\n0.000000 0.000003 0.242961 Mg\n0.000000 0.333333 0.666668 Ag\n0.000000 0.666664 0.333331 Ag\n0.500000 -0.000004 0.000000 Ag\n",
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{
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"created_at": "2022-09-04T14:38:53.513943Z",
"updated_at": "2022-09-04T14:38:53.513978Z",
"structure_string": "In1 Ge1 Cl1\n1.0\n5.253467 -0.000000 0.000000\n-2.626733 4.549636 0.000000\n-0.000000 0.000000 3.076641\nIn Ge Cl\n1 1 1\ndirect\n0.666668 0.333334 0.000000 In\n0.333335 0.666667 0.000000 Ge\n0.000000 0.000000 0.000000 Cl\n",
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{
"id": "jvasp-63943",
"created_at": "2022-09-04T14:36:09.089409Z",
"updated_at": "2022-09-04T14:36:09.089430Z",
"structure_string": "Ba4 In1 Pd1\n1.0\n0.000000 4.917232 4.917232\n4.917232 -0.000000 4.917232\n4.917232 4.917232 -0.000000\nBa In Pd\n4 1 1\ndirect\n0.124212 0.625263 0.625263 Ba\n0.625263 0.625263 0.625263 Ba\n0.625263 0.124212 0.625263 Ba\n0.625263 0.625263 0.124212 Ba\n0.250000 0.250000 0.250000 In\n0.000000 0.000000 0.000000 Pd\n",
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{
"id": "jvasp-59047",
"created_at": "2022-09-04T14:38:36.299997Z",
"updated_at": "2022-09-04T14:38:36.300014Z",
"structure_string": "K8 Sn4 Te12\n1.0\n8.091680 0.000000 -3.015519\n-0.000000 8.679865 0.000000\n-0.002391 0.000000 12.357730\nK Sn Te\n8 4 12\ndirect\n0.077757 0.000000 0.155515 K\n0.422243 0.500000 0.844485 K\n0.922243 0.000000 0.844485 K\n0.577757 0.500000 0.155515 K\n0.234601 0.000000 0.469201 K\n0.734601 0.500000 0.469201 K\n0.265400 0.500000 0.530799 K\n0.765400 0.000000 0.530799 K\n0.585332 0.000000 0.170666 Sn\n0.914668 0.500000 0.829334 Sn\n0.414668 0.000000 0.829334 Sn\n0.085332 0.500000 0.170666 Sn\n0.671527 0.828220 -0.000000 Te\n0.341765 0.309915 0.302903 Te\n0.538863 0.190085 0.697097 Te\n0.158235 0.809915 0.697097 Te\n0.961137 0.690085 0.302903 Te\n0.658235 0.690085 0.697097 Te\n0.461137 0.809915 0.302903 Te\n0.841765 0.190085 0.302903 Te\n0.038863 0.309915 0.697097 Te\n0.828473 0.328220 -0.000000 Te\n0.328473 0.171781 -0.000000 Te\n0.171527 0.671781 -0.000000 Te\n",
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{
"id": "jvasp-114956",
"created_at": "2022-09-04T14:38:43.817323Z",
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"structure_string": "Ga1 I3\n1.0\n5.290353 0.000000 0.000000\n-2.645177 4.581580 -0.000000\n-0.000000 -0.000000 8.093947\nGa I\n1 3\ndirect\n0.666666 0.333333 0.000000 Ga\n0.333332 0.666667 0.670980 I\n0.000000 0.000000 0.000000 I\n0.333332 0.666667 0.329020 I\n",
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{
"id": "jvasp-66546",
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"structure_string": "Ba1 Na1 Sb1\n1.0\n0.000000 3.949682 3.949682\n3.949682 -0.000000 3.949682\n3.949682 3.949682 -0.000000\nBa Na Sb\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Sb\n",
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