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{
"id": "jvasp-106810",
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"structure_string": "Er1 Si2 Pt2\n1.0\n3.913070 -0.026915 -4.316211\n-0.602232 3.866543 -4.316211\n0.023208 0.026915 5.825913\nEr Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.750000 0.249999 0.500000 Si\n0.250001 0.750000 0.500000 Si\n0.633475 0.633473 -0.000001 Pt\n0.366525 0.366525 -0.000000 Pt\n",
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{
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{
"id": "jvasp-7824",
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"structure_string": "Tm1 Sb1 Pt1\n1.0\n4.014301 -0.000000 2.317658\n1.338101 3.784719 2.317658\n0.000000 0.000000 4.635316\nTm Sb Pt\n1 1 1\ndirect\n0.500000 0.500000 0.500001 Tm\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 3,
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"density": 11.454185371698841,
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"volume": 70.42436185825225,
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"formula_full": "Tm1 Sb1 Pt1",
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"spacegroup": 216
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{
"id": "jvasp-93291",
"created_at": "2022-09-04T14:35:57.346400Z",
"updated_at": "2022-09-04T14:35:57.346424Z",
"structure_string": "Mg1 Hg5\n1.0\n3.754690 0.000000 0.000000\n1.877344 7.489420 0.000000\n0.000000 0.000000 5.295844\nMg Hg\n1 5\ndirect\n0.783046 0.433907 0.499999 Mg\n0.324805 0.350393 0.000000 Hg\n0.660680 0.678641 0.000000 Hg\n-0.005071 0.010140 0.000000 Hg\n0.444544 0.110916 0.499999 Hg\n0.125332 0.749339 0.499999 Hg\n",
"nsites": 6,
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"elements": [
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"density": 11.454335659109097,
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"volume": 148.92151842116155,
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"formula_full": "Mg1 Hg5",
"formula_reduced": "MgHg5",
"formula_anonymous": "AB5",
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"spacegroup": 38
},
{
"id": "jvasp-56298",
"created_at": "2022-09-04T14:37:52.581550Z",
"updated_at": "2022-09-04T14:37:52.581581Z",
"structure_string": "Tb1 Si2 Pt2\n1.0\n3.940409 -0.000000 -1.542569\n-0.603876 3.893862 -1.542569\n-0.024537 -0.028635 5.741389\nTb Si Pt\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tb\n0.380461 0.380463 0.760922 Si\n0.619538 0.619538 0.239077 Si\n0.750000 0.250001 0.500000 Pt\n0.249999 0.750000 0.500000 Pt\n",
"nsites": 5,
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"elements": [
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"volume": 87.7443684507511,
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"formula_full": "Tb1 Si2 Pt2",
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{
"id": "jvasp-64962",
"created_at": "2022-09-04T14:36:07.982513Z",
"updated_at": "2022-09-04T14:36:07.982541Z",
"structure_string": "Be2 Pt1 Pb1\n1.0\n-1.903935 1.903935 4.202074\n1.903935 -1.903935 4.202074\n1.903935 1.903935 -4.202074\nBe Pt Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n0.750001 0.250000 0.500001 Pt\n0.500000 0.500000 0.000000 Pb\n",
"nsites": 4,
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"elements": [
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{
"id": "jvasp-14273",
"created_at": "2022-09-04T14:37:03.796827Z",
"updated_at": "2022-09-04T14:37:03.796854Z",
"structure_string": "Ti1 Cd1 Hg2\n1.0\n4.449802 0.000000 0.000000\n-0.000000 4.449802 0.000000\n-0.000000 0.000000 4.110486\nTi Cd Hg\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 0.500001 Hg\n0.000000 0.500000 0.500001 Hg\n",
"nsites": 4,
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{
"id": "jvasp-16474",
"created_at": "2022-09-04T14:37:38.322354Z",
"updated_at": "2022-09-04T14:37:38.322381Z",
"structure_string": "Ti1 Cd1 Hg2\n1.0\n4.449802 0.000000 -0.000000\n0.000000 4.449802 0.000000\n0.000000 0.000000 4.110486\nTi Cd Hg\n1 1 2\ndirect\n0.500000 0.500000 0.000000 Ti\n0.000000 0.000000 0.000000 Cd\n0.500000 0.000000 0.500001 Hg\n0.000000 0.500000 0.500001 Hg\n",
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"formula_full": "Ti1 Cd1 Hg2",
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{
"id": "jvasp-106246",
"created_at": "2022-09-04T14:38:40.016343Z",
"updated_at": "2022-09-04T14:38:40.016373Z",
"structure_string": "Fe2 Rh6\n1.0\n5.353898 -0.000000 -0.000000\n-2.676948 4.636612 0.000000\n0.000000 0.000000 4.257807\nFe Rh\n2 6\ndirect\n0.333333 0.666667 0.750000 Fe\n0.666667 0.333333 0.250000 Fe\n0.169646 0.339292 0.250000 Rh\n0.660707 0.830353 0.250000 Rh\n0.169646 0.830353 0.250000 Rh\n0.830354 0.660707 0.750000 Rh\n0.339293 0.169646 0.750000 Rh\n0.830354 0.169646 0.750000 Rh\n",
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"elements": [
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"formula_full": "Fe2 Rh6",
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{
"id": "jvasp-93670",
"created_at": "2022-09-04T14:36:09.105386Z",
"updated_at": "2022-09-04T14:36:09.105412Z",
"structure_string": "Ho2 Sn2 Au2\n1.0\n-2.357858 -4.083888 0.000000\n-2.357858 4.083888 -0.000000\n0.000000 0.000000 -7.234803\nHo Sn Au\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Ho\n0.000000 0.000000 0.000000 Ho\n0.666671 0.333330 0.250000 Sn\n0.333330 0.666671 0.750000 Sn\n0.666666 0.333335 0.750000 Au\n0.333335 0.666666 0.250000 Au\n",
"nsites": 6,
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{
"id": "jvasp-99889",
"created_at": "2022-09-04T14:36:38.138940Z",
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"structure_string": "Ho4 Sn2 Au4\n1.0\n8.269228 -0.000000 0.000000\n-0.000000 8.269228 0.000000\n0.000000 -0.000000 3.571832\nHo Sn Au\n4 2 4\ndirect\n0.837517 0.337517 0.500000 Ho\n0.162483 0.662483 0.500000 Ho\n0.337517 0.162483 0.500000 Ho\n0.662483 0.837517 0.500000 Ho\n0.000000 0.000000 0.500000 Sn\n0.500000 0.500000 0.500000 Sn\n0.630261 0.130261 0.000000 Au\n0.369739 0.869739 0.000000 Au\n0.130261 0.369739 0.000000 Au\n0.869739 0.630261 0.000000 Au\n",
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{
"id": "jvasp-107167",
"created_at": "2022-09-04T14:37:01.675352Z",
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"structure_string": "Dy1 Ho1 Tl2\n1.0\n4.610752 -0.000000 2.662019\n1.536917 4.347058 2.662019\n-0.000000 -0.000000 5.324037\nDy Ho Tl\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Ho\n0.250000 0.250000 0.250000 Tl\n0.750000 0.750000 0.750001 Tl\n",
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