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{
"id": "jvasp-94403",
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"structure_string": "Mg4 Sb2\n1.0\n3.571023 -0.000000 0.000000\n-1.785511 3.092597 -0.000000\n-0.000000 0.000000 13.771762\nMg Sb\n4 2\ndirect\n0.000000 0.000000 0.500000 Mg\n0.666667 0.333333 0.326140 Mg\n0.666667 0.333333 0.000000 Mg\n0.666667 0.333333 0.673860 Mg\n0.000000 0.000000 0.159583 Sb\n0.000000 0.000000 0.840417 Sb\n",
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{
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"structure_string": "Mg4 Sb2\n1.0\n3.529964 -0.000000 0.000000\n-1.764982 3.057038 0.000000\n0.000000 0.000000 13.931202\nMg Sb\n4 2\ndirect\n0.333333 0.666667 0.914854 Mg\n0.333333 0.666667 0.585146 Mg\n0.666667 0.333333 0.414854 Mg\n0.666667 0.333333 0.085146 Mg\n0.666667 0.333333 0.750000 Sb\n0.333333 0.666667 0.250000 Sb\n",
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{
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"structure_string": "Mg4 Sb2\n1.0\n6.443522 0.000000 0.000000\n-3.221760 5.580254 -0.000000\n0.000000 0.000000 4.252987\nMg Sb\n4 2\ndirect\n-0.000000 0.353759 0.000000 Mg\n0.646241 0.646241 -0.000000 Mg\n0.353759 -0.000000 -0.000000 Mg\n-0.000000 -0.000000 0.500000 Mg\n0.666667 0.333333 0.500000 Sb\n0.333333 0.666666 0.500000 Sb\n",
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{
"id": "jvasp-90584",
"created_at": "2022-09-04T14:37:51.752991Z",
"updated_at": "2022-09-04T14:37:51.753012Z",
"structure_string": "Mg4 Sb4\n1.0\n11.995066 0.000000 1.319001\n0.000000 4.103714 0.000000\n-1.909105 0.000000 3.938772\nMg Sb\n4 4\ndirect\n0.863623 0.499999 0.720076 Mg\n0.636377 0.000000 0.279923 Mg\n0.363623 0.000000 0.720077 Mg\n0.136377 0.499999 0.279923 Mg\n0.616774 0.499999 0.756351 Sb\n0.883226 0.000000 0.243648 Sb\n0.116774 0.000000 0.756351 Sb\n0.383226 0.499999 0.243649 Sb\n",
"nsites": 8,
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"elements": [
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"chemical_system": "Mg-Sb",
"density": 4.750763323906895,
"density_atomic": 0.0391740190516547,
"volume": 204.21698344127606,
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"formula_full": "Mg4 Sb4",
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"spacegroup": 12
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{
"id": "jvasp-80486",
"created_at": "2022-09-04T14:37:19.608111Z",
"updated_at": "2022-09-04T14:37:19.608132Z",
"structure_string": "Mg3 Sb1\n1.0\n4.497494 0.000000 0.000000\n0.000000 4.497494 0.000000\n0.000000 -0.000000 4.497494\nMg Sb\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Sb\n",
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"spacegroup": 221
},
{
"id": "jvasp-78545",
"created_at": "2022-09-04T14:37:17.400240Z",
"updated_at": "2022-09-04T14:37:17.400271Z",
"structure_string": "Mg1 Sb1\n1.0\n3.452328 0.000000 0.000000\n0.000000 3.452328 0.000000\n0.000000 -0.000000 4.098194\nMg Sb\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 2,
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{
"id": "jvasp-92318",
"created_at": "2022-09-04T14:35:48.822457Z",
"updated_at": "2022-09-04T14:35:48.822482Z",
"structure_string": "Mg3 Sb3\n1.0\n3.858050 0.000000 0.000000\n-1.929024 3.341170 -0.000000\n-0.000000 -0.000000 11.910174\nMg Sb\n3 3\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666667 0.333333 0.333333 Mg\n0.333334 0.666667 0.666667 Mg\n0.333334 0.666667 0.166667 Sb\n0.000000 0.000000 0.500000 Sb\n0.666667 0.333333 0.833333 Sb\n",
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},
{
"id": "jvasp-90582",
"created_at": "2022-09-04T14:35:50.879443Z",
"updated_at": "2022-09-04T14:35:50.879472Z",
"structure_string": "Mg6 Sb2\n1.0\n6.271576 0.000000 0.000000\n-3.135788 5.431344 -0.000000\n0.000000 -0.000000 5.410653\nMg Sb\n6 2\ndirect\n0.329063 0.164531 0.250000 Mg\n0.835469 0.164531 0.250000 Mg\n0.835468 0.670936 0.250000 Mg\n0.670937 0.835468 0.750000 Mg\n0.164531 0.329063 0.750000 Mg\n0.164531 0.835468 0.750000 Mg\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n",
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{
"id": "jvasp-110827",
"created_at": "2022-09-04T14:38:37.457706Z",
"updated_at": "2022-09-04T14:38:37.457723Z",
"structure_string": "Mg1 Sc3\n1.0\n3.233343 0.000000 0.000000\n-1.616672 2.800157 0.000000\n-0.000000 -0.000000 10.545267\nMg Sc\n1 3\ndirect\n0.333334 0.666667 0.500000 Mg\n0.666666 0.333334 0.757711 Sc\n0.333334 0.666667 -0.000000 Sc\n0.666666 0.333334 0.242289 Sc\n",
"nsites": 4,
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},
{
"id": "jvasp-100608",
"created_at": "2022-09-04T14:36:46.994295Z",
"updated_at": "2022-09-04T14:36:46.994313Z",
"structure_string": "Mg4 Sc2\n1.0\n6.002869 0.010404 1.566353\n5.164878 3.059178 1.566353\n-0.003424 -0.000941 7.560071\nMg Sc\n4 2\ndirect\n0.196456 0.196456 0.857903 Mg\n0.860170 0.860168 0.530789 Mg\n0.139832 0.139832 0.469210 Mg\n0.803545 0.803544 0.142096 Mg\n0.476383 0.476382 0.805659 Sc\n0.523619 0.523618 0.194340 Sc\n",
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{
"id": "jvasp-100208",
"created_at": "2022-09-04T14:36:40.029008Z",
"updated_at": "2022-09-04T14:36:40.029021Z",
"structure_string": "Mg2 Sc2\n1.0\n3.567999 0.000000 0.000000\n0.000000 5.058239 0.000000\n0.000000 -0.000000 5.059329\nMg Sc\n2 2\ndirect\n0.500000 0.750000 0.250285 Mg\n0.500000 0.250000 0.749715 Mg\n0.000000 0.750000 0.750251 Sc\n0.000000 0.250000 0.249749 Sc\n",
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{
"id": "jvasp-102116",
"created_at": "2022-09-04T14:36:39.782609Z",
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"structure_string": "Mg5 Sc1\n1.0\n5.578897 0.000000 0.000000\n-2.789449 4.831467 -0.000000\n0.000000 0.000000 5.111264\nMg Sc\n5 1\ndirect\n0.000000 0.659475 0.000000 Mg\n0.333333 0.666667 0.500000 Mg\n0.659475 0.000000 0.000000 Mg\n0.666667 0.333333 0.500000 Mg\n0.340525 0.340525 0.000000 Mg\n0.000000 0.000000 0.500000 Sc\n",
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