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{
"id": "jvasp-8649",
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"structure_string": "Li1 W1 O2\n1.0\n2.918300 0.153901 4.866564\n1.464142 2.529120 4.866564\n0.251381 0.153901 5.668927\nLi W O\n1 1 2\ndirect\n0.500002 0.500001 0.499998 Li\n0.000000 0.000000 0.000000 W\n0.245380 0.245381 0.245382 O\n0.754620 0.754619 0.754617 O\n",
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{
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{
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"structure_string": "Mg2 Ni1 Ir1\n1.0\n3.757452 -0.000000 2.169366\n1.252484 3.542560 2.169366\n-0.000000 -0.000000 4.338732\nMg Ni Ir\n2 1 1\ndirect\n0.250000 0.250000 0.250001 Mg\n0.749999 0.750000 0.750002 Mg\n0.000000 0.000000 0.000000 Ni\n0.499999 0.500000 0.500001 Ir\n",
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{
"id": "jvasp-10873",
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"updated_at": "2022-09-04T14:36:49.957519Z",
"structure_string": "Pr4 Cu4 Se8\n1.0\n0.000000 6.748693 0.006548\n7.557578 0.000000 0.000000\n0.000000 -0.841344 -7.209300\nPr Cu Se\n4 4 8\ndirect\n0.308208 0.546365 0.700663 Pr\n0.691792 0.046365 0.799336 Pr\n0.691792 0.453635 0.299336 Pr\n0.308208 0.953635 0.200663 Pr\n0.934999 0.837608 0.455608 Cu\n0.065001 0.162392 0.544392 Cu\n0.935000 0.662392 0.955608 Cu\n0.065001 0.337608 0.044392 Cu\n0.583976 0.723790 0.999182 Se\n0.583976 0.776211 0.499182 Se\n0.416024 0.223789 0.500818 Se\n0.416024 0.276211 0.000818 Se\n0.100435 0.610158 0.280087 Se\n0.899565 0.110158 0.219912 Se\n0.899565 0.389842 0.719912 Se\n0.100435 0.889842 0.780087 Se\n",
"nsites": 16,
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"formula_full": "Pr4 Cu4 Se8",
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{
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"created_at": "2022-09-04T14:36:49.971864Z",
"updated_at": "2022-09-04T14:36:49.971896Z",
"structure_string": "Zn1 Sn2 N2\n1.0\n3.382296 -0.043614 0.150166\n-0.041003 3.382594 0.147126\n0.365966 0.373376 7.710577\nZn Sn N\n1 2 2\ndirect\n0.014124 0.985890 0.750005 Zn\n0.357573 0.411025 0.066913 Sn\n0.588845 0.642573 0.433086 Sn\n0.051327 0.511918 0.597424 N\n0.488137 0.948593 0.902575 N\n",
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{
"id": "jvasp-102842",
"created_at": "2022-09-04T14:36:50.050111Z",
"updated_at": "2022-09-04T14:36:50.050134Z",
"structure_string": "Li3 Mn1 O4\n1.0\n2.380715 -0.004547 4.303599\n-0.072649 2.822097 9.543026\n-0.067653 -0.019680 9.537328\nLi Mn O\n3 1 4\ndirect\n0.998150 0.004494 -0.004529 Li\n0.998148 0.504464 0.995510 Li\n0.498151 0.004530 0.495439 Li\n0.498130 0.504445 0.495533 Mn\n0.271289 0.004527 0.222268 O\n0.178402 0.504511 0.268716 O\n0.724967 0.004499 0.768652 O\n0.817877 0.504519 0.722193 O\n",
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"volume": 65.35228437336366,
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{
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"created_at": "2022-09-04T14:36:50.166537Z",
"updated_at": "2022-09-04T14:36:50.166555Z",
"structure_string": "Hf2 Cu1 Sb3\n1.0\n3.930730 0.000000 0.000000\n0.000000 3.930730 0.000000\n-0.000000 0.000000 8.546005\nHf Cu Sb\n2 1 3\ndirect\n0.500000 0.000000 0.737061 Hf\n0.000000 0.500000 0.262940 Hf\n0.000000 0.000000 0.000000 Cu\n0.500000 0.500000 0.000000 Sb\n0.500000 0.000000 0.375283 Sb\n0.000000 0.500000 0.624717 Sb\n",
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{
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"created_at": "2022-09-04T14:36:50.593231Z",
"updated_at": "2022-09-04T14:36:50.593259Z",
"structure_string": "Sm2 Cd1 Sb4\n1.0\n4.342186 0.000000 0.000000\n0.000000 4.342186 0.000000\n0.000000 0.000000 10.775814\nSm Cd Sb\n2 1 4\ndirect\n0.500000 -0.000000 0.765874 Sm\n-0.000000 0.500000 0.234126 Sm\n0.500000 0.500000 0.500000 Cd\n0.500000 -0.000000 0.324566 Sb\n-0.000000 0.500000 0.675433 Sb\n0.500000 0.500000 -0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n",
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},
{
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"created_at": "2022-09-04T14:36:50.612581Z",
"updated_at": "2022-09-04T14:36:50.612595Z",
"structure_string": "Ba2 Pd4 S8\n1.0\n0.000000 6.773185 0.022068\n6.836409 0.000000 0.000000\n0.000000 -2.537291 -6.824455\nBa Pd S\n2 4 8\ndirect\n0.280748 0.250000 0.490881 Ba\n0.719251 0.750000 0.509119 Ba\n0.000000 0.000000 0.000000 Pd\n0.000000 0.500000 0.000000 Pd\n0.480987 0.750000 0.986861 Pd\n0.519012 0.250000 0.013138 Pd\n0.369997 0.496555 0.147049 S\n0.630002 0.996555 0.852950 S\n0.630002 0.503445 0.852950 S\n0.369997 0.003445 0.147049 S\n0.027211 0.250000 0.786209 S\n0.972788 0.750000 0.213790 S\n0.207209 0.750000 0.495409 S\n0.792790 0.250000 0.504590 S\n",
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{
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"structure_string": "Sr1 As2 Pd2\n1.0\n4.126858 0.000000 -1.632529\n-0.645806 4.076015 -1.632529\n0.010914 0.012779 6.059983\nSr As Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.624731 0.624732 0.249463 As\n0.375268 0.375269 0.750536 As\n0.249999 0.750001 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
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{
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"structure_string": "Nd1 Si2 Pd2\n1.0\n3.961575 0.000000 -1.549322\n-0.605920 3.914963 -1.549322\n-0.005235 -0.006107 5.826096\nNd Si Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Nd\n0.619724 0.619724 0.239451 Si\n0.380276 0.380274 0.760550 Si\n0.750000 0.249999 0.500000 Pd\n0.250000 0.749999 0.500000 Pd\n",
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{
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