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{
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{
"id": "jvasp-98702",
"created_at": "2022-09-04T14:35:49.037973Z",
"updated_at": "2022-09-04T14:35:49.037998Z",
"structure_string": "Ce4 Si4 Ir4\n1.0\n6.330838 0.000000 -0.000000\n-0.000000 6.330838 -0.000000\n0.000000 -0.000000 6.330838\nCe Si Ir\n4 4 4\ndirect\n0.123322 0.876678 0.376678 Ce\n0.876678 0.376678 0.123322 Ce\n0.623323 0.623323 0.623323 Ce\n0.376678 0.123322 0.876678 Ce\n0.084449 0.415551 0.584449 Si\n0.584449 0.084449 0.415551 Si\n0.415551 0.584449 0.084449 Si\n0.915551 0.915551 0.915551 Si\n0.687818 0.812182 0.187818 Ir\n0.187818 0.687818 0.812182 Ir\n0.312182 0.312182 0.312182 Ir\n0.812182 0.187818 0.687818 Ir\n",
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{
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{
"id": "jvasp-41504",
"created_at": "2022-09-04T14:37:43.100080Z",
"updated_at": "2022-09-04T14:37:43.100104Z",
"structure_string": "Tm2 Mg1 Ir1\n1.0\n-0.000000 3.483952 3.483952\n3.483952 -0.000000 3.483952\n3.483952 3.483952 -0.000000\nTm Mg Ir\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Tm\n0.499999 0.499999 0.499999 Tm\n0.749999 0.749999 0.749999 Mg\n0.250000 0.250000 0.250000 Ir\n",
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},
{
"id": "jvasp-108718",
"created_at": "2022-09-04T14:38:17.400584Z",
"updated_at": "2022-09-04T14:38:17.400605Z",
"structure_string": "Zn1 Cu2 Sn1 Se1 S3\n1.0\n5.048469 0.001295 -2.266345\n-1.004475 4.938192 -2.267540\n-0.007184 0.008771 6.782914\nZn Cu Sn Se S\n1 2 1 1 3\ndirect\n0.245914 0.763635 0.504803 Zn\n0.977505 0.980767 0.983893 Cu\n0.773393 0.246137 0.514141 Cu\n0.503694 0.506272 0.998536 Sn\n0.369721 0.358712 0.261288 Se\n0.888718 0.898307 0.257427 S\n0.106995 0.631243 0.740140 S\n0.634069 0.114921 0.739767 S\n",
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"density": 4.774665708561909,
"density_atomic": 0.04729559054513124,
"volume": 169.1489609875174,
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"formula_full": "Zn1 Cu2 Sn1 Se1 S3",
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{
"id": "jvasp-5371",
"created_at": "2022-09-04T14:38:14.710380Z",
"updated_at": "2022-09-04T14:38:14.710405Z",
"structure_string": "S6 N4 Cl4\n1.0\n0.000000 5.434283 0.170331\n8.647902 0.000000 0.000000\n0.000000 -1.482107 -6.345107\nS N Cl\n6 4 4\ndirect\n0.675394 0.172166 0.875317 S\n0.117530 0.776843 0.712411 S\n0.152591 0.522998 0.736028 S\n0.324605 0.672166 0.124684 S\n0.847409 0.022998 0.263972 S\n0.882469 0.276844 0.287590 S\n0.247419 0.514122 0.983103 N\n0.254563 0.804189 0.958352 N\n0.745436 0.304190 0.041649 N\n0.752580 0.014122 0.016898 N\n0.499158 0.989468 0.405467 Cl\n0.500841 0.489469 0.594534 Cl\n0.892580 0.647412 0.284300 Cl\n0.107419 0.147412 0.715701 Cl\n",
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"formula_full": "S6 N4 Cl4",
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{
"id": "jvasp-19089",
"created_at": "2022-09-04T14:37:03.114734Z",
"updated_at": "2022-09-04T14:37:03.114769Z",
"structure_string": "Sc8 S12\n1.0\n6.261234 0.006332 -1.173503\n-2.350894 5.803136 -1.173503\n0.001975 0.002933 11.631551\nSc S\n8 12\ndirect\n0.127254 0.377254 0.754508 Sc\n0.872746 0.622746 0.245492 Sc\n0.377254 0.127254 0.254508 Sc\n0.791315 0.041316 0.082631 Sc\n0.958683 0.208684 0.417369 Sc\n0.208684 0.958684 0.917369 Sc\n0.041316 0.791316 0.582631 Sc\n0.622746 0.872746 0.745492 Sc\n0.540354 0.283626 0.087702 S\n0.195925 0.952653 0.412298 S\n0.882500 0.632501 0.750000 S\n0.459645 0.716374 0.912298 S\n0.804074 0.047347 0.587702 S\n0.283625 0.540354 0.587702 S\n0.952651 0.195924 0.912298 S\n0.632501 0.882501 0.250000 S\n0.117499 0.367499 0.250000 S\n0.367498 0.117498 0.750000 S\n0.047348 0.804076 0.087702 S\n0.716374 0.459646 0.412298 S\n",
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"formula_full": "Sc8 S12",
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{
"id": "jvasp-90054",
"created_at": "2022-09-04T14:35:44.430978Z",
"updated_at": "2022-09-04T14:35:44.431005Z",
"structure_string": "Y3 In3 Cu3\n1.0\n0.000000 0.000000 -3.905751\n-3.750166 -6.495479 0.000000\n-3.750067 6.495421 0.000000\nY In Cu\n3 3 3\ndirect\n0.500000 0.591735 0.000000 Y\n0.500000 0.408245 0.408258 Y\n0.500000 0.999987 0.591743 Y\n0.000000 0.256815 0.000000 In\n0.000000 0.743168 0.743184 In\n0.000000 0.999985 0.256818 In\n0.000000 0.333323 0.666664 Cu\n0.000000 0.666659 0.333336 Cu\n0.500000 0.999991 0.000000 Cu\n",
"nsites": 9,
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"volume": 190.27798860511916,
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"formula_full": "Y3 In3 Cu3",
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},
{
"id": "jvasp-40040",
"created_at": "2022-09-04T14:37:51.183437Z",
"updated_at": "2022-09-04T14:37:51.183466Z",
"structure_string": "Y1 Mg1 Ag2\n1.0\n0.000010 3.483802 3.483802\n3.483804 0.000008 3.483804\n3.483806 3.483807 0.000005\nY Mg Ag\n1 1 2\ndirect\n0.749999 0.749999 0.750002 Y\n0.250001 0.249999 0.250001 Mg\n0.000000 0.000000 0.000000 Ag\n0.499999 0.500000 0.500001 Ag\n",
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{
"id": "jvasp-79655",
"created_at": "2022-09-04T14:36:42.872696Z",
"updated_at": "2022-09-04T14:36:42.872718Z",
"structure_string": "Ga4\n1.0\n3.877929 2.332415 0.000000\n-3.877929 2.332415 0.000000\n0.000000 0.000000 4.674611\nGa\n4\ndirect\n0.008541 0.334174 0.250000 Ga\n0.665824 0.991457 0.750000 Ga\n0.991457 0.665824 0.750000 Ga\n0.334174 0.008541 0.250000 Ga\n",
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{
"id": "jvasp-79126",
"created_at": "2022-09-04T14:37:16.450234Z",
"updated_at": "2022-09-04T14:37:16.450254Z",
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{
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"created_at": "2022-09-04T14:36:04.378763Z",
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{
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"created_at": "2022-09-04T14:36:57.484786Z",
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"structure_string": "Sm2 Cd1 Ni2\n1.0\n7.439722 0.014425 0.000000\n-6.407666 3.780408 0.000000\n0.000000 0.000000 3.745849\nSm Cd Ni\n2 1 2\ndirect\n0.636847 0.363152 0.500000 Sm\n0.363152 0.636848 0.500000 Sm\n0.000000 0.000000 0.000000 Cd\n0.799510 0.200488 -0.000000 Ni\n0.200489 0.799511 -0.000000 Ni\n",
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