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{
"id": "jvasp-107520",
"created_at": "2022-09-04T14:36:53.184172Z",
"updated_at": "2022-09-04T14:36:53.184187Z",
"structure_string": "Ta2 V1 C2\n1.0\n3.033649 0.001043 6.805377\n1.448978 2.665237 6.805377\n0.001753 0.001043 7.450918\nTa V C\n2 1 2\ndirect\n0.776839 0.776838 0.776840 Ta\n0.223161 0.223161 0.223161 Ta\n0.000000 0.000000 0.000000 V\n0.611489 0.611488 0.611490 C\n0.388511 0.388511 0.388512 C\n",
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{
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"structure_string": "Ca1 Cu2 N2\n1.0\n3.589120 0.000000 0.000000\n0.000000 3.589131 0.000000\n0.000000 0.000000 6.111196\nCa Cu N\n1 2 2\ndirect\n0.000000 0.000000 0.250005 Ca\n0.500000 0.500000 0.957799 Cu\n0.500000 0.500000 0.542202 Cu\n0.500000 0.000000 0.508750 N\n0.000000 0.500000 0.991248 N\n",
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{
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"structure_string": "Pr1 Mn2 Si2\n1.0\n3.760589 -0.000000 -1.341228\n-0.478355 3.730042 -1.341228\n0.017524 0.019914 5.991793\nPr Mn Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Pr\n0.250000 0.749999 0.499999 Mn\n0.750000 0.249999 0.499999 Mn\n0.627187 0.627186 0.254373 Si\n0.372813 0.372812 0.745626 Si\n",
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{
"id": "jvasp-15527",
"created_at": "2022-09-04T14:36:59.561054Z",
"updated_at": "2022-09-04T14:36:59.561062Z",
"structure_string": "Ca1 P2 Ru2\n1.0\n3.810108 -0.000000 -1.458031\n-0.557952 3.769033 -1.458031\n0.001483 0.001719 5.711151\nCa P Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.632685 0.632684 0.265371 P\n0.367315 0.367315 0.734629 P\n0.250000 0.750000 0.500000 Ru\n0.750000 0.250000 0.500000 Ru\n",
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"density": 6.156970875456006,
"density_atomic": 0.060950604776677304,
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{
"id": "jvasp-18532",
"created_at": "2022-09-04T14:36:59.423549Z",
"updated_at": "2022-09-04T14:36:59.423577Z",
"structure_string": "Ca1 Mn2 Bi2\n1.0\n2.276635 -3.943248 0.000000\n2.276635 3.943248 -0.000000\n0.000000 0.000000 7.750326\nCa Mn Bi\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333334 0.385428 Mn\n0.333334 0.666668 0.614573 Mn\n0.666668 0.333334 0.751436 Bi\n0.333334 0.666668 0.248565 Bi\n",
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{
"id": "jvasp-8295",
"created_at": "2022-09-04T14:36:45.728186Z",
"updated_at": "2022-09-04T14:36:45.728207Z",
"structure_string": "Ca1 W2 N2\n1.0\n3.360426 0.000000 0.000000\n0.000000 3.360995 0.000000\n0.000000 0.000000 7.641936\nCa W N\n1 2 2\ndirect\n0.000000 0.000000 0.249998 Ca\n0.500001 0.499999 0.916962 W\n0.500001 0.499999 0.583014 W\n0.500001 0.000000 0.460675 N\n0.000000 0.499999 0.039352 N\n",
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{
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"created_at": "2022-09-04T14:37:01.067838Z",
"updated_at": "2022-09-04T14:37:01.067869Z",
"structure_string": "Tl1 Fe2 Se2\n1.0\n3.560976 -0.000000 -0.950347\n-0.253626 3.551932 -0.950347\n0.243345 0.261340 8.058532\nTl Fe Se\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tl\n0.249999 0.750000 0.499999 Fe\n0.750000 0.250000 0.499999 Fe\n0.641533 0.641533 0.283066 Se\n0.358466 0.358467 0.716934 Se\n",
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{
"id": "jvasp-50214",
"created_at": "2022-09-04T14:37:00.021188Z",
"updated_at": "2022-09-04T14:37:00.021201Z",
"structure_string": "Y2 Se1 O2\n1.0\n-1.914039 1.914039 6.033974\n1.914039 -1.914039 6.033974\n1.914039 1.914039 -6.033974\nY Se O\n2 1 2\ndirect\n0.343810 0.343810 0.000000 Y\n0.656189 0.656189 0.000000 Y\n0.000000 0.000000 0.000000 Se\n0.750000 0.250000 0.500000 O\n0.250000 0.750000 0.500000 O\n",
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"spacegroup": 139
},
{
"id": "jvasp-99880",
"created_at": "2022-09-04T14:36:47.131392Z",
"updated_at": "2022-09-04T14:36:47.131419Z",
"structure_string": "Dy4 Ni2 As4\n1.0\n4.099805 -0.000000 -0.000000\n-2.049901 3.550535 -0.000000\n-0.000000 -0.000000 14.203809\nDy Ni As\n4 2 4\ndirect\n0.666666 0.333333 0.619775 Dy\n0.333332 0.666666 0.119775 Dy\n0.666666 0.333333 0.354029 Dy\n0.333332 0.666666 0.854029 Dy\n0.000000 0.000000 0.986620 Ni\n0.000000 0.000000 0.486620 Ni\n0.666666 0.333333 0.986995 As\n0.333332 0.666666 0.486995 As\n0.000000 0.000000 0.736911 As\n0.000000 0.000000 0.236911 As\n",
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"density": 8.570013132957293,
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"volume": 206.75776198144888,
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"formula_full": "Dy4 Ni2 As4",
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"formula_anonymous": "AB2C2",
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"spacegroup": 194
},
{
"id": "jvasp-52381",
"created_at": "2022-09-04T14:36:46.811328Z",
"updated_at": "2022-09-04T14:36:46.811340Z",
"structure_string": "Sn8 O4 F8\n1.0\n7.931978 0.000000 0.000000\n0.000000 7.931978 -0.000000\n0.000000 0.000000 5.604333\nSn O F\n8 4 8\ndirect\n0.227802 0.500000 0.185874 Sn\n0.000000 0.727802 0.685874 Sn\n0.000000 0.272198 0.685874 Sn\n0.772199 0.500000 0.185874 Sn\n0.727802 0.000000 0.314125 Sn\n0.500000 0.227802 0.814125 Sn\n0.500000 0.772199 0.814125 Sn\n0.272198 0.000000 0.314125 Sn\n0.500000 0.000000 0.107321 O\n0.500000 0.000000 0.607320 O\n0.000000 0.500000 0.892679 O\n0.000000 0.500000 0.392679 O\n0.199953 0.199953 0.000000 F\n0.199953 0.800047 0.000000 F\n0.800047 0.199953 0.000000 F\n0.800047 0.800047 0.000000 F\n0.699953 0.699953 0.500000 F\n0.699953 0.300047 0.500000 F\n0.300047 0.699953 0.500000 F\n0.300047 0.300047 0.500000 F\n",
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},
{
"id": "jvasp-15806",
"created_at": "2022-09-04T14:36:53.778536Z",
"updated_at": "2022-09-04T14:36:53.778556Z",
"structure_string": "Ca1 Zn2 Sb2\n1.0\n2.243378 -3.885644 0.000000\n2.243378 3.885644 -0.000000\n0.000000 0.000000 7.429067\nCa Zn Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.333334 0.666667 0.365798 Zn\n0.666667 0.333334 0.634202 Zn\n0.333334 0.666667 0.745395 Sb\n0.666667 0.333334 0.254605 Sb\n",
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{
"id": "jvasp-106653",
"created_at": "2022-09-04T14:36:59.535116Z",
"updated_at": "2022-09-04T14:36:59.535143Z",
"structure_string": "Nd2 Ga1 Co2\n1.0\n4.767814 -0.015626 -2.799913\n-0.876326 3.703068 -4.011377\n0.009179 0.015626 5.529148\nNd Ga Co\n2 1 2\ndirect\n0.294209 0.794210 0.500000 Nd\n0.705790 0.205791 0.500000 Nd\n0.000000 0.000000 0.000000 Ga\n0.713124 0.500000 0.213124 Co\n0.286875 0.500001 0.786876 Co\n",
"nsites": 5,
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