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{
"id": "jvasp-90673",
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"updated_at": "2022-09-04T14:36:02.858742Z",
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{
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{
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"formula_full": "Zr2 Ga4",
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{
"id": "jvasp-18712",
"created_at": "2022-09-04T14:36:19.840622Z",
"updated_at": "2022-09-04T14:36:19.840656Z",
"structure_string": "Zr4 Ga4\n1.0\n3.820198 0.000000 -0.705783\n-0.130394 3.817971 -0.705783\n-0.015198 -0.015726 10.609444\nZr Ga\n4 4\ndirect\n0.321780 0.571779 0.143558 Zr\n0.071780 0.821778 0.643557 Zr\n0.678221 0.428220 0.856443 Zr\n0.928221 0.178220 0.356443 Zr\n0.459195 0.709194 0.418389 Ga\n0.209195 0.959193 0.918388 Ga\n0.540806 0.290805 0.581611 Ga\n0.790806 0.040806 0.081612 Ga\n",
"nsites": 8,
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"elements": [
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"formula_full": "Zr4 Ga4",
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"spacegroup": 141
},
{
"id": "jvasp-123393",
"created_at": "2022-09-04T14:38:54.413681Z",
"updated_at": "2022-09-04T14:38:54.413729Z",
"structure_string": "Zr1 Ga1\n1.0\n1.563847 -2.708660 0.000000\n1.563847 2.708660 0.000000\n0.000000 0.000000 4.709194\nZr Ga\n1 1\ndirect\n0.333334 0.666668 0.749999 Zr\n0.666668 0.333334 0.250000 Ga\n",
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"elements": [
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"spacegroup": 187
},
{
"id": "jvasp-114946",
"created_at": "2022-09-04T14:38:42.421145Z",
"updated_at": "2022-09-04T14:38:42.421172Z",
"structure_string": "Zr1 Fe1 Te1\n1.0\n2.964780 0.000000 0.000000\n-0.000000 2.964780 0.000000\n-0.000000 -0.000000 7.861876\nZr Fe Te\n1 1 1\ndirect\n0.000000 0.000000 0.007327 Zr\n0.000000 0.000000 0.293442 Fe\n0.000000 0.000000 0.619189 Te\n",
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{
"id": "jvasp-40764",
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"structure_string": "Zr1 Fe1 Te1\n1.0\n3.733136 0.000000 2.155327\n1.244379 3.519635 2.155327\n-0.000000 0.000000 4.310655\nZr Fe Te\n1 1 1\ndirect\n0.500000 0.500001 0.499999 Zr\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Te\n",
"nsites": 3,
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"spacegroup": 216
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{
"id": "jvasp-92411",
"created_at": "2022-09-04T14:35:47.662981Z",
"updated_at": "2022-09-04T14:35:47.663009Z",
"structure_string": "Zr1 Fe2 Si2\n1.0\n3.627243 0.000000 -1.312653\n-0.475032 3.596003 -1.312653\n-0.093102 -0.106210 5.410621\nZr Fe Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Zr\n0.250000 0.749999 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.371552 0.371551 0.743104 Si\n0.628448 0.628448 0.256897 Si\n",
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"volume": 69.56245394461169,
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"formula_full": "Zr1 Fe2 Si2",
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"spacegroup": 139
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{
"id": "jvasp-40766",
"created_at": "2022-09-04T14:38:05.786835Z",
"updated_at": "2022-09-04T14:38:05.786862Z",
"structure_string": "Zr1 Fe1 Se1\n1.0\n3.581294 0.000000 2.067661\n1.193764 3.376476 2.067661\n-0.000000 -0.000000 4.135322\nZr Fe Se\n1 1 1\ndirect\n0.499999 0.500001 0.500000 Zr\n0.249999 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Se\n",
"nsites": 3,
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},
{
"id": "jvasp-40767",
"created_at": "2022-09-04T14:37:55.773518Z",
"updated_at": "2022-09-04T14:37:55.773532Z",
"structure_string": "Zr1 Fe1 Sb1\n1.0\n3.772196 0.000000 2.177878\n1.257398 3.556461 2.177878\n0.000000 0.000000 4.355757\nZr Fe Sb\n1 1 1\ndirect\n0.500001 0.500000 0.500000 Zr\n0.250000 0.250000 0.250000 Fe\n0.000000 0.000000 0.000000 Sb\n",
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{
"id": "jvasp-23502",
"created_at": "2022-09-04T14:37:40.889670Z",
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"structure_string": "Zr4 Fe4 P4\n1.0\n3.767783 -0.000000 0.000000\n-0.000000 6.337753 0.000000\n0.000000 0.000000 7.087282\nZr Fe P\n4 4 4\ndirect\n0.250000 0.514177 0.686292 Zr\n0.749999 0.485822 0.313708 Zr\n0.250000 0.014178 0.813708 Zr\n0.749999 0.985822 0.186292 Zr\n0.749999 0.854292 0.562852 Fe\n0.250000 0.145708 0.437148 Fe\n0.749999 0.354292 0.937148 Fe\n0.250000 0.645708 0.062852 Fe\n0.250000 0.282475 0.110922 P\n0.749999 0.717524 0.889078 P\n0.250000 0.782475 0.389078 P\n0.749999 0.217524 0.610921 P\n",
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"formula_full": "Zr4 Fe4 P4",
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{
"id": "jvasp-85406",
"created_at": "2022-09-04T14:36:03.311154Z",
"updated_at": "2022-09-04T14:36:03.311191Z",
"structure_string": "Zr1 Fe1 F6\n1.0\n4.747499 0.097694 3.129996\n1.735560 4.419968 3.129997\n0.140195 0.097693 5.684713\nZr Fe F\n1 1 6\ndirect\n0.500000 0.499999 0.500001 Zr\n0.000000 0.000000 0.000000 Fe\n0.378107 0.749722 0.125704 F\n0.874297 0.621892 0.250279 F\n0.749722 0.125703 0.378108 F\n0.250278 0.874296 0.621893 F\n0.621892 0.250277 0.874297 F\n0.125703 0.378107 0.749722 F\n",
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}
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