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{
"id": "jvasp-118527",
"created_at": "2022-09-04T14:38:53.002035Z",
"updated_at": "2022-09-04T14:38:53.002080Z",
"structure_string": "Hf1 O2\n1.0\n4.040260 0.000000 0.016248\n0.000000 3.319642 0.000000\n-0.015496 0.000000 3.726952\nHf O\n1 2\ndirect\n0.590396 0.000000 -0.033358 Hf\n-0.303628 0.000000 -0.533354 O\n0.113232 0.000000 -0.033286 O\n",
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{
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"updated_at": "2022-09-04T14:38:53.048228Z",
"structure_string": "Au1 S2\n1.0\n5.737592 0.861900 0.874635\n2.248774 -3.532328 0.197389\n0.198709 -2.378554 -2.947406\nAu S\n1 2\ndirect\n0.054380 0.100996 0.510745 Au\n0.378579 0.599954 0.429635 S\n0.730171 0.602049 0.591842 S\n",
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{
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"structure_string": "Th1 Se2\n1.0\n2.167546 -3.754440 -0.006592\n2.167669 3.754511 0.000000\n0.008927 -0.005154 6.169523\nTh Se\n1 2\ndirect\n0.000000 0.333319 0.166667 Th\n0.666674 0.666679 0.414097 Se\n0.333327 0.000005 0.919236 Se\n",
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{
"id": "jvasp-118753",
"created_at": "2022-09-04T14:38:53.657329Z",
"updated_at": "2022-09-04T14:38:53.657355Z",
"structure_string": "N1 Cl2\n1.0\n4.474429 0.000000 0.199838\n0.000000 3.099683 0.000000\n0.213234 0.000000 4.680731\nN Cl\n1 2\ndirect\n0.565106 0.000000 -0.108479 N\n0.190270 0.000000 -0.021542 Cl\n-0.355376 0.000000 0.530021 Cl\n",
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"formula_full": "N1 Cl2",
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"spacegroup": 6
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{
"id": "jvasp-119966",
"created_at": "2022-09-04T14:38:49.411866Z",
"updated_at": "2022-09-04T14:38:49.411889Z",
"structure_string": "Ba1 Se2\n1.0\n4.873952 0.000000 -1.867244\n0.000000 5.209251 0.000000\n-0.801502 0.000000 5.974838\nBa Se\n1 2\ndirect\n0.466730 0.000000 0.133345 Ba\n-0.263452 0.000000 -0.277091 Se\n0.196722 0.000000 0.543746 Se\n",
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"elements": [
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"density": 3.4069463340706103,
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"volume": 143.90281786759985,
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"formula_full": "Ba1 Se2",
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"spacegroup": 10
},
{
"id": "jvasp-120308",
"created_at": "2022-09-04T14:38:53.659779Z",
"updated_at": "2022-09-04T14:38:53.659806Z",
"structure_string": "Li2 Sb1\n1.0\n4.825078 0.000000 -0.000000\n-2.412539 4.178640 0.000000\n-0.000000 0.000000 3.366645\nLi Sb\n2 1\ndirect\n0.333333 0.666666 0.000000 Li\n0.666667 0.333333 0.000000 Li\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 3,
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"elements": [
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"density": 3.3182313527578495,
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"volume": 67.8791850618121,
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{
"id": "jvasp-117704",
"created_at": "2022-09-04T14:38:53.611822Z",
"updated_at": "2022-09-04T14:38:53.611848Z",
"structure_string": "Be1 S2\n1.0\n4.211851 0.000000 0.000000\n-2.105926 3.647570 -0.000000\n-0.000000 0.000000 3.693350\nBe S\n1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.333332 0.666666 0.000000 S\n0.666666 0.333333 0.000000 S\n",
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{
"id": "jvasp-113486",
"created_at": "2022-09-04T14:38:49.417117Z",
"updated_at": "2022-09-04T14:38:49.417145Z",
"structure_string": "Ba1 I2\n1.0\n5.493711 1.872449 0.860099\n-4.080292 -7.070138 1.433951\n-2.390570 0.271859 -5.332320\nBa I\n1 2\ndirect\n0.703840 0.053436 0.178721 Ba\n0.704009 0.303902 0.678135 I\n0.703549 0.802906 0.679195 I\n",
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{
"id": "jvasp-121255",
"created_at": "2022-09-04T14:38:52.994590Z",
"updated_at": "2022-09-04T14:38:52.994609Z",
"structure_string": "Na2 P1\n1.0\n4.368121 0.000000 0.000000\n0.000000 3.022740 0.000000\n0.000000 0.000000 7.061291\nNa P\n2 1\ndirect\n-0.033341 0.000000 0.767735 Na\n-0.033341 0.000000 0.232265 Na\n0.466683 0.000000 0.000000 P\n",
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{
"id": "jvasp-118592",
"created_at": "2022-09-04T14:38:53.333829Z",
"updated_at": "2022-09-04T14:38:53.333857Z",
"structure_string": "La1 N2\n1.0\n4.031842 0.295713 0.586618\n-0.446637 -4.041837 0.326736\n-1.473942 1.530654 -3.066752\nLa N\n1 2\ndirect\n-0.124121 0.860027 0.070244 La\n0.282937 0.476582 0.095181 N\n0.468964 0.243697 0.045823 N\n",
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"spacegroup": 12
},
{
"id": "jvasp-120269",
"created_at": "2022-09-04T14:38:53.345290Z",
"updated_at": "2022-09-04T14:38:53.345319Z",
"structure_string": "Ir1 O2\n1.0\n3.310275 0.000000 0.000000\n0.000000 2.718944 0.000000\n0.000000 0.000000 3.799391\nIr O\n1 2\ndirect\n0.800002 0.000000 0.000000 Ir\n-0.700002 0.000000 0.290582 O\n-0.700002 0.000000 0.709419 O\n",
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{
"id": "jvasp-115855",
"created_at": "2022-09-04T14:38:48.827771Z",
"updated_at": "2022-09-04T14:38:48.827795Z",
"structure_string": "Cd1 P2\n1.0\n5.384769 0.000000 0.000000\n0.000000 5.129110 0.000000\n0.000000 0.000000 2.684379\nCd P\n1 2\ndirect\n0.000000 0.423984 0.000000 Cd\n0.207883 0.924008 0.000000 P\n0.792117 0.924008 0.000000 P\n",
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