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{
"id": "jvasp-101212",
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"structure_string": "Ce1 Si1 Ni1\n1.0\n4.070569 -0.000000 0.000000\n-2.035284 3.525216 0.000000\n0.000000 0.000000 3.944556\nCe Si Ni\n1 1 1\ndirect\n0.666667 0.333334 -0.000000 Ce\n0.333334 0.666667 0.500001 Si\n0.000000 0.000000 0.500001 Ni\n",
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"structure_string": "Co1 Ni2 Se4\n1.0\n5.527323 0.013162 3.009584\n4.328629 3.437214 3.009584\n-0.009038 -0.003164 6.186019\nCo Ni Se\n1 2 4\ndirect\n0.740613 0.740611 0.279504 Co\n0.002133 0.002133 0.003057 Ni\n0.259164 0.259166 0.721421 Ni\n0.877119 0.877118 0.454604 Se\n0.121386 0.121387 0.535101 Se\n0.634793 0.634791 0.028819 Se\n0.364792 0.364793 0.977493 Se\n",
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{
"id": "jvasp-10121",
"created_at": "2022-09-04T14:38:08.665507Z",
"updated_at": "2022-09-04T14:38:08.665535Z",
"structure_string": "Na6 Sb2 O8\n1.0\n0.000000 5.489817 -0.009701\n6.617298 0.000000 0.000000\n0.000000 -1.949944 -5.474576\nNa Sb O\n6 2 8\ndirect\n0.250000 0.615616 -0.000000 Na\n0.750001 0.601462 0.500000 Na\n0.250001 0.874703 0.500000 Na\n0.750001 0.125297 0.500000 Na\n0.750000 0.384384 -0.000000 Na\n0.250001 0.398538 0.500000 Na\n0.250000 0.132710 -0.000000 Sb\n0.750000 0.867290 -0.000000 Sb\n0.039320 0.335344 0.770974 O\n0.460682 0.335344 0.229027 O\n0.960682 0.664656 0.229027 O\n0.539320 0.664656 0.770974 O\n0.500674 0.097724 0.801465 O\n0.999327 0.097724 0.198536 O\n0.000674 0.902277 0.801465 O\n0.499327 0.902277 0.198536 O\n",
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"volume": 199.00423145557252,
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"formula_full": "Na6 Sb2 O8",
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"spacegroup": 13
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{
"id": "jvasp-101209",
"created_at": "2022-09-04T14:36:48.313493Z",
"updated_at": "2022-09-04T14:36:48.313520Z",
"structure_string": "Cr1 Cu1 P2 Se6\n1.0\n6.203995 -0.003477 0.882800\n-3.289466 5.260130 0.882800\n0.035816 0.064598 6.935609\nCr Cu P Se\n1 1 2 6\ndirect\n0.331542 0.668457 0.000000 Cr\n0.675528 0.324471 0.000000 Cu\n0.052676 0.054251 0.832467 P\n0.945747 0.947324 0.167533 P\n0.096613 0.437753 0.752552 Se\n0.418131 0.063805 0.750679 Se\n0.936194 0.581868 0.249322 Se\n0.562246 0.903387 0.247449 Se\n0.721051 0.739733 0.754283 Se\n0.260267 0.278949 0.245717 Se\n",
"nsites": 10,
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"volume": 225.54828004228517,
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"formula_full": "Cr1 Cu1 P2 Se6",
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{
"id": "jvasp-101207",
"created_at": "2022-09-04T14:36:48.327637Z",
"updated_at": "2022-09-04T14:36:48.327658Z",
"structure_string": "Cr1 B4 Mo1\n1.0\n2.995753 -0.000000 0.000000\n-1.497876 2.594399 0.000000\n-0.000000 -0.000000 6.352933\nCr B Mo\n1 4 1\ndirect\n0.000000 0.000000 0.000000 Cr\n0.666666 0.333334 0.764578 B\n0.666666 0.333334 0.235421 B\n0.333332 0.666667 0.764578 B\n0.333332 0.666667 0.235421 B\n0.000000 0.000000 0.500000 Mo\n",
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{
"id": "jvasp-101204",
"created_at": "2022-09-04T14:36:48.135891Z",
"updated_at": "2022-09-04T14:36:48.135919Z",
"structure_string": "Cu1 Si2 P3\n1.0\n3.750869 0.000000 0.000000\n-1.875434 3.248348 0.000000\n0.000000 0.000000 9.069523\nCu Si P\n1 2 3\ndirect\n0.333334 0.666667 0.734290 Cu\n0.666667 0.333334 0.083124 Si\n0.000000 0.000000 0.432840 Si\n0.333334 0.666667 0.991852 P\n0.666667 0.333334 0.335345 P\n0.000000 0.000000 0.672548 P\n",
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{
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"created_at": "2022-09-04T14:36:41.068433Z",
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"structure_string": "Er2 Fe2 Ni2\n1.0\n4.407192 0.088981 -2.486501\n-1.300307 4.010210 -2.800244\n-0.027791 -0.088981 5.060164\nEr Fe Ni\n2 2 2\ndirect\n0.130262 0.880263 0.250000 Er\n0.869737 0.119737 0.750000 Er\n0.500000 0.500000 0.500000 Fe\n0.500000 -0.000000 -0.000000 Fe\n0.499999 0.500000 -0.000000 Ni\n-0.000000 0.500000 0.500000 Ni\n",
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{
"id": "jvasp-10120",
"created_at": "2022-09-04T14:38:11.639129Z",
"updated_at": "2022-09-04T14:38:11.639149Z",
"structure_string": "Na2 Au2 F8\n1.0\n5.107833 -0.000000 -2.418809\n-1.145424 4.977747 -2.418809\n-0.002375 -0.002984 6.597530\nNa Au F\n2 2 8\ndirect\n0.250000 0.250001 0.500000 Na\n0.750000 0.750001 0.500000 Na\n0.000000 0.500000 0.000000 Au\n0.500000 0.000000 -0.000000 Au\n0.956876 0.456877 0.262500 F\n0.694375 0.194377 0.737499 F\n0.043124 0.543125 0.737500 F\n0.194375 0.043124 0.737500 F\n0.305624 0.805625 0.262501 F\n0.456876 0.305625 0.262500 F\n0.805624 0.956877 0.262500 F\n0.543123 0.694377 0.737500 F\n",
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{
"id": "jvasp-101195",
"created_at": "2022-09-04T14:36:45.606165Z",
"updated_at": "2022-09-04T14:36:45.606191Z",
"structure_string": "Fe4 N1\n1.0\n2.557620 -0.046537 7.970101\n1.208788 2.254422 7.970101\n-0.079387 -0.046537 8.370044\nFe N\n4 1\ndirect\n0.872777 0.872772 0.872777 Fe\n0.127225 0.127224 0.127225 Fe\n0.380092 0.380091 0.380093 Fe\n0.619909 0.619906 0.619909 Fe\n0.000000 0.000000 0.000000 N\n",
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{
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"structure_string": "Ga2 Co1 Ni1\n1.0\n2.891993 0.000000 0.000000\n0.000000 2.891993 0.000000\n-0.000000 0.000000 5.792922\nGa Co Ni\n2 1 1\ndirect\n0.000000 0.000000 0.753624 Ga\n0.000000 0.000000 0.246376 Ga\n0.499999 0.499999 -0.000000 Co\n0.499999 0.499999 0.500000 Ni\n",
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{
"id": "jvasp-101193",
"created_at": "2022-09-04T14:36:44.476949Z",
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"structure_string": "Fe2 Sb1 Te3\n1.0\n3.761196 0.000000 0.000000\n0.000000 5.394832 0.074008\n0.000000 0.004875 6.319497\nFe Sb Te\n2 1 3\ndirect\n0.500001 0.503957 0.500364 Fe\n-0.000000 0.998583 0.996539 Fe\n0.500001 0.280985 0.145814 Sb\n0.500001 0.713875 0.860705 Te\n-0.000000 0.778988 0.354742 Te\n-0.000000 0.223615 0.641838 Te\n",
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