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{
"id": "jvasp-13005",
"created_at": "2022-09-04T14:36:59.525323Z",
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"structure_string": "Cd4 P6 Br2\n1.0\n6.106035 0.001422 -0.737294\n-0.813020 6.051667 -0.737294\n-0.010057 -0.011502 7.604485\nCd P Br\n4 6 2\ndirect\n0.643987 0.350825 0.413091 Cd\n0.350825 0.643987 0.913090 Cd\n0.145516 0.852368 0.500297 Cd\n0.852368 0.145516 0.000297 Cd\n0.944879 0.551443 0.956663 P\n0.551443 0.944879 0.456663 P\n0.680515 0.585434 0.739054 P\n0.585434 0.680515 0.239055 P\n0.815799 0.910913 0.674292 P\n0.910914 0.815799 0.174292 P\n0.123240 0.373083 0.456604 Br\n0.373082 0.123241 0.956603 Br\n",
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"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",
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{
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"updated_at": "2022-09-04T14:36:59.546776Z",
"structure_string": "Na1 Cu4 S4\n1.0\n1.919496 -3.324665 0.000000\n1.919496 3.324665 -0.000000\n-0.000000 0.000000 12.131590\nNa Cu S\n1 4 4\ndirect\n0.000000 0.000000 0.500000 Na\n0.666668 0.333334 0.147920 Cu\n0.333334 0.666668 0.852080 Cu\n0.333334 0.666668 0.315104 Cu\n0.666668 0.333334 0.684896 Cu\n0.000000 0.000000 0.087242 S\n0.000000 0.000000 0.912758 S\n0.666668 0.333334 0.342760 S\n0.333334 0.666668 0.657240 S\n",
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"formula_full": "Na1 Cu4 S4",
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{
"id": "jvasp-107048",
"created_at": "2022-09-04T14:36:59.551157Z",
"updated_at": "2022-09-04T14:36:59.551185Z",
"structure_string": "Mg1 Be4 Cu1\n1.0\n3.809935 -0.000000 2.199667\n1.269978 3.592041 2.199667\n-0.000000 -0.000000 4.399334\nMg Be Cu\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.623644 0.623643 0.129070 Be\n0.623644 0.129070 0.623643 Be\n0.129071 0.623643 0.623643 Be\n0.623644 0.623643 0.623643 Be\n0.250000 0.250000 0.250000 Cu\n",
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"volume": 60.206833495417584,
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"formula_full": "Mg1 Be4 Cu1",
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"spacegroup": 216
},
{
"id": "jvasp-60657",
"created_at": "2022-09-04T14:36:59.552001Z",
"updated_at": "2022-09-04T14:36:59.552026Z",
"structure_string": "In4 Te4 I4\n1.0\n0.000000 8.536890 -0.132754\n7.783654 0.000000 0.000000\n0.000000 -3.809828 -7.067956\nIn Te I\n4 4 4\ndirect\n0.612158 0.803085 0.968528 In\n0.887841 0.303085 0.031471 In\n0.387841 0.196914 0.031472 In\n0.112158 0.696914 0.968529 In\n0.936958 0.637670 0.197839 Te\n0.563041 0.137670 0.802161 Te\n0.063041 0.362330 0.802161 Te\n0.436959 0.862330 0.197839 Te\n0.395712 0.605352 0.660842 I\n0.104287 0.105353 0.339158 I\n0.604287 0.394647 0.339158 I\n0.895712 0.894647 0.660842 I\n",
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{
"id": "jvasp-18532",
"created_at": "2022-09-04T14:36:59.423549Z",
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"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",
"nsites": 5,
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"density": 6.776959446678,
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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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"formula_full": "Ca1 P2 Ru2",
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{
"id": "jvasp-15573",
"created_at": "2022-09-04T14:36:59.570170Z",
"updated_at": "2022-09-04T14:36:59.570189Z",
"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-8273",
"created_at": "2022-09-04T14:36:59.624014Z",
"updated_at": "2022-09-04T14:36:59.624037Z",
"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": "Hf1 Al1 Ni2\n1.0\n3.726156 -0.000000 2.151297\n1.242052 3.513053 2.151297\n0.000000 -0.000000 4.302594\nHf Al Ni\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Ni\n0.750001 0.749999 0.750000 Ni\n",
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{
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"created_at": "2022-09-04T14:37:00.116413Z",
"updated_at": "2022-09-04T14:37:00.116438Z",
"structure_string": "Na1 Nb1 N2\n1.0\n3.040041 -0.000582 5.111039\n1.404691 2.696051 5.111039\n-0.000958 -0.000582 5.946811\nNa Nb N\n1 1 2\ndirect\n0.499999 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Nb\n0.732436 0.732438 0.732438 N\n0.267562 0.267563 0.267563 N\n",
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"structure_string": "Sm2 Al2 Ge2\n1.0\n4.068812 -0.000000 -1.126286\n-0.311766 4.056849 -1.126286\n0.003100 0.003348 7.923827\nSm Al Ge\n2 2 2\ndirect\n0.334951 0.834953 0.669903 Sm\n0.584951 0.584952 0.169903 Sm\n0.919161 0.419163 0.838324 Al\n0.169162 0.169162 0.338324 Al\n0.003486 0.003486 0.006971 Ge\n0.753485 0.253486 0.506972 Ge\n",
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