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{
"id": "jvasp-15159",
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{
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"structure_string": "Nd1 Ge2 Au2\n1.0\n4.469470 -0.000000 -0.000000\n-0.000000 4.469470 -0.000000\n-2.234735 -2.234735 5.244814\nNd Ge Au\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.617484 0.617484 0.234967 Ge\n0.382517 0.382517 0.765032 Ge\n0.250000 0.750000 0.500000 Au\n0.750000 0.250000 0.500000 Au\n",
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{
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"created_at": "2022-09-04T14:36:37.326471Z",
"updated_at": "2022-09-04T14:36:37.326493Z",
"structure_string": "Er1 Fe2 B2\n1.0\n3.389497 0.000000 -1.188612\n-0.416817 3.363771 -1.188612\n-0.055587 -0.062900 5.268610\nEr Fe B\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.249999 0.750000 0.500000 Fe\n0.750000 0.250000 0.500000 Fe\n0.654524 0.654524 0.309050 B\n0.345475 0.345475 0.690950 B\n",
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{
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"created_at": "2022-09-04T14:36:38.523805Z",
"updated_at": "2022-09-04T14:36:38.523831Z",
"structure_string": "Ca1 Mg2 Sb2\n1.0\n2.331295 -4.037921 0.000000\n2.331295 4.037921 0.000000\n0.000000 0.000000 7.541484\nCa Mg Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.666668 0.333334 0.368473 Mg\n0.333334 0.666668 0.631527 Mg\n0.333334 0.666668 0.243201 Sb\n0.666668 0.333334 0.756799 Sb\n",
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{
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"created_at": "2022-09-04T14:36:21.698303Z",
"updated_at": "2022-09-04T14:36:21.698328Z",
"structure_string": "Ce2 Bi1 O2\n1.0\n3.871197 0.000000 -1.090819\n-0.307369 3.858975 -1.090819\n-0.099654 -0.107907 7.060977\nCe Bi O\n2 1 2\ndirect\n0.657067 0.657066 0.314132 Ce\n0.342935 0.342934 0.685868 Ce\n0.000000 0.000000 0.000000 Bi\n0.250001 0.750000 0.500000 O\n0.750001 0.250000 0.500000 O\n",
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{
"id": "jvasp-100303",
"created_at": "2022-09-04T14:36:37.316770Z",
"updated_at": "2022-09-04T14:36:37.316781Z",
"structure_string": "Sm4 Mg2 Si4\n1.0\n7.291902 0.000000 -0.000000\n0.000000 7.291902 0.000000\n0.000000 0.000000 4.316648\nSm Mg Si\n4 2 4\ndirect\n0.679384 0.179384 0.500000 Sm\n0.320616 0.820616 0.500000 Sm\n0.179384 0.320616 0.500000 Sm\n0.820616 0.679384 0.500000 Sm\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.000000 Mg\n0.117100 0.617100 0.000000 Si\n0.882900 0.382900 0.000000 Si\n0.617100 0.882900 0.000000 Si\n0.382900 0.117100 0.000000 Si\n",
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"formula_full": "Sm4 Mg2 Si4",
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{
"id": "jvasp-96903",
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"updated_at": "2022-09-04T14:36:33.310446Z",
"structure_string": "U4 Fe4 Sn2\n1.0\n3.364639 -0.000000 0.000000\n0.000000 7.277791 0.000000\n0.000000 0.000000 7.277791\nU Fe Sn\n4 4 2\ndirect\n0.500000 0.834640 0.334640 U\n0.500000 0.665360 0.834640 U\n0.500000 0.334640 0.165360 U\n0.500000 0.165360 0.665360 U\n0.000000 0.135197 0.364803 Fe\n0.000000 0.364803 0.864803 Fe\n0.000000 0.635197 0.135197 Fe\n0.000000 0.864803 0.635197 Fe\n0.000000 0.000000 0.000000 Sn\n0.000000 0.500000 0.500000 Sn\n",
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"density": 13.165207127333716,
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"volume": 178.21228297722243,
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"formula_full": "U4 Fe4 Sn2",
"formula_reduced": "U2Fe2Sn",
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"spacegroup": 127
},
{
"id": "jvasp-100860",
"created_at": "2022-09-04T14:36:33.784133Z",
"updated_at": "2022-09-04T14:36:33.784155Z",
"structure_string": "Li2 V1 N2\n1.0\n2.972622 0.000286 -0.000055\n-1.486363 2.573945 -0.000316\n-0.000655 -0.000861 5.438779\nLi V N\n2 1 2\ndirect\n0.666647 0.333313 0.365259 Li\n0.333357 0.666691 0.634741 Li\n0.000000 0.000000 0.000000 V\n0.666829 0.333525 0.786166 N\n0.333175 0.666479 0.213834 N\n",
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"formula_full": "Li2 V1 N2",
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"spacegroup": 164
},
{
"id": "jvasp-100445",
"created_at": "2022-09-04T14:36:40.543305Z",
"updated_at": "2022-09-04T14:36:40.543325Z",
"structure_string": "Sr2 Pd1 N2\n1.0\n3.675546 -0.000440 -1.039874\n-0.293752 3.663789 -1.039874\n0.005703 0.006178 7.035910\nSr Pd N\n2 1 2\ndirect\n0.149988 0.649989 0.799977 Sr\n0.850013 0.350012 0.200024 Sr\n0.500000 0.000000 0.500000 Pd\n0.648826 0.148826 0.797652 N\n0.351175 0.851175 0.202349 N\n",
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{
"id": "jvasp-15201",
"created_at": "2022-09-04T14:36:21.018362Z",
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"structure_string": "Yb1 Si2 Ru2\n1.0\n3.920054 0.000000 -1.574104\n-0.632084 3.868759 -1.574104\n-0.035795 -0.042118 5.579045\nYb Si Ru\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.633712 0.633713 0.267426 Si\n0.366286 0.366287 0.732574 Si\n0.749999 0.250000 0.500000 Ru\n0.250000 0.750000 0.500000 Ru\n",
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{
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"created_at": "2022-09-04T14:36:39.821851Z",
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"structure_string": "Si4 Se2 N4\n1.0\n6.098924 0.002013 0.000000\n-2.582602 4.981195 0.000000\n-0.000000 -0.000000 4.915848\nSi Se N\n4 2 4\ndirect\n0.624674 0.166040 0.909654 Si\n0.375325 0.541365 0.909654 Si\n0.375325 0.833959 0.409654 Si\n0.624674 0.458634 0.409654 Si\n-0.000000 0.781998 0.263513 Se\n-0.000000 0.218001 0.763513 Se\n0.555365 0.150055 0.255391 N\n0.444634 0.594689 0.255391 N\n0.444634 0.849943 0.755391 N\n0.555365 0.405310 0.755391 N\n",
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