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{
"id": "jvasp-116205",
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{
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"structure_string": "Ge1 H2\n1.0\n6.728344 0.000000 0.000000\n0.000000 2.589188 0.000000\n0.000000 0.000000 2.610688\nGe H\n1 2\ndirect\n0.467169 0.000000 0.000000 Ge\n-0.033585 0.000000 0.857483 H\n-0.033585 0.000000 0.142517 H\n",
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{
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"structure_string": "B2 Br1\n1.0\n8.328137 0.000000 -4.397166\n0.000000 3.421533 0.000000\n-5.119897 0.000000 4.749852\nB Br\n2 1\ndirect\n-0.212842 0.000000 -0.331060 B\n0.292830 0.000000 0.173670 B\n0.082231 0.000000 0.345612 Br\n",
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{
"id": "jvasp-114089",
"created_at": "2022-09-04T14:38:48.212154Z",
"updated_at": "2022-09-04T14:38:48.212179Z",
"structure_string": "Ba1 Te2\n1.0\n5.993372 -0.000000 0.000000\n-2.996686 5.190413 0.000000\n-0.000000 0.000000 4.679237\nBa Te\n1 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.333332 0.666666 0.000000 Te\n0.666665 0.333333 0.000000 Te\n",
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},
{
"id": "jvasp-49233",
"created_at": "2022-09-04T14:38:35.409167Z",
"updated_at": "2022-09-04T14:38:35.409189Z",
"structure_string": "Na8 Se16\n1.0\n8.567923 0.062027 -3.898978\n-5.035470 7.787809 -1.615318\n0.040106 -0.062027 9.413274\nNa Se\n8 16\ndirect\n0.496175 0.875000 0.871174 Na\n0.003826 0.128825 0.625000 Na\n0.996174 0.621175 0.125000 Na\n0.503826 0.375000 0.378825 Na\n0.500000 0.943354 0.443353 Na\n0.500000 0.556647 0.056647 Na\n0.000000 0.806646 0.806646 Na\n0.000000 0.193353 0.193352 Na\n0.743677 0.723110 0.432981 Se\n0.756323 0.729434 0.939304 Se\n0.243677 0.182982 0.973109 Se\n0.709872 0.020567 0.276890 Se\n0.790128 0.060695 0.817018 Se\n0.209872 0.026890 0.270566 Se\n0.240169 0.018710 0.536600 Se\n0.482110 0.463400 0.703569 Se\n0.740169 0.286600 0.268709 Se\n0.517891 0.221460 0.981290 Se\n0.256323 0.689305 0.979433 Se\n0.017891 0.731290 0.471459 Se\n0.982110 0.453569 0.713399 Se\n0.259831 0.528540 0.546430 Se\n0.759831 0.296431 0.778540 Se\n0.290128 0.567018 0.310695 Se\n",
"nsites": 24,
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{
"id": "jvasp-118813",
"created_at": "2022-09-04T14:38:49.268721Z",
"updated_at": "2022-09-04T14:38:49.268745Z",
"structure_string": "Na1 Zn2\n1.0\n5.511361 0.000000 -1.143920\n0.000000 2.755201 0.000000\n-0.981845 0.000000 4.437456\nNa Zn\n1 2\ndirect\n0.466667 0.000000 0.133327 Na\n-0.145555 0.000000 -0.173736 Zn\n0.078888 0.000000 0.440410 Zn\n",
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{
"id": "jvasp-116305",
"created_at": "2022-09-04T14:38:41.230090Z",
"updated_at": "2022-09-04T14:38:41.230127Z",
"structure_string": "Li2 Se1\n1.0\n9.091301 -0.000000 0.000000\n-0.000000 9.091301 0.000000\n0.000000 -0.000000 11.224076\nLi Se\n2 1\ndirect\n0.000000 0.000000 0.194737 Li\n0.000000 0.000000 0.805263 Li\n0.000000 0.000000 0.000000 Se\n",
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{
"id": "jvasp-116273",
"created_at": "2022-09-04T14:38:41.504384Z",
"updated_at": "2022-09-04T14:38:41.504409Z",
"structure_string": "Li1 H2\n1.0\n4.446406 0.000000 0.014345\n0.000000 2.715440 0.000000\n-0.005973 0.000000 2.310419\nLi H\n1 2\ndirect\n0.466663 0.000000 0.133198 Li\n-0.125702 0.000000 -0.366582 H\n0.059040 0.000000 0.633385 H\n",
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"elements": [
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{
"id": "jvasp-113662",
"created_at": "2022-09-04T14:38:48.159002Z",
"updated_at": "2022-09-04T14:38:48.159026Z",
"structure_string": "Li1 Br2\n1.0\n4.219697 0.713139 -0.046354\n-1.140942 -5.632288 -0.052105\n0.322959 3.260294 -3.415423\nLi Br\n1 2\ndirect\n-0.012117 0.031606 0.027075 Li\n0.132932 0.885436 0.381237 Br\n0.618170 0.400422 0.396326 Br\n",
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{
"id": "jvasp-113480",
"created_at": "2022-09-04T14:38:48.168068Z",
"updated_at": "2022-09-04T14:38:48.168095Z",
"structure_string": "Ba1 I2\n1.0\n4.938912 0.000000 0.000000\n0.000000 5.462895 0.000000\n0.000000 0.000000 8.765572\nBa I\n1 2\ndirect\n0.466687 0.000000 0.000000 Ba\n-0.033344 0.000000 0.741396 I\n-0.033344 0.000000 0.258603 I\n",
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{
"id": "jvasp-114086",
"created_at": "2022-09-04T14:38:48.198592Z",
"updated_at": "2022-09-04T14:38:48.198626Z",
"structure_string": "Ba2 Te1\n1.0\n4.033238 0.000000 2.301454\n0.000000 4.429012 0.000000\n1.709262 0.000000 10.879712\nBa Te\n2 1\ndirect\n0.045092 0.000000 -0.143701 Ba\n0.221574 0.000000 0.410368 Ba\n0.133334 0.000000 0.133333 Te\n",
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{
"id": "jvasp-110725",
"created_at": "2022-09-04T14:38:48.225742Z",
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"structure_string": "Cu1 I2\n1.0\n5.233325 -0.000000 0.000000\n0.000000 5.233325 0.000000\n0.000000 -0.000000 4.204480\nCu I\n1 2\ndirect\n0.000000 0.000000 0.000000 Cu\n-0.000000 0.500000 -0.000000 I\n0.500000 0.000000 -0.000000 I\n",
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