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{
"id": "jvasp-79111",
"created_at": "2022-09-04T14:36:45.066121Z",
"updated_at": "2022-09-04T14:36:45.066149Z",
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{
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"structure_string": "Zn3 C1\n1.0\n3.714940 -0.000000 0.000000\n-0.000000 3.714940 -0.000000\n0.000000 0.000000 3.714940\nZn C\n3 1\ndirect\n0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 C\n",
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{
"id": "jvasp-37605",
"created_at": "2022-09-04T14:37:52.642563Z",
"updated_at": "2022-09-04T14:37:52.642573Z",
"structure_string": "Zn3 Cd1\n1.0\n-2.058585 2.058585 4.098909\n2.058585 -2.058585 4.098909\n2.058585 2.058585 -4.098909\nZn Cd\n3 1\ndirect\n0.749999 0.250000 0.499999 Zn\n0.250000 0.749999 0.499999 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Cd\n",
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"elements": [
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"density": 7.376198877290368,
"density_atomic": 0.05756971977286963,
"volume": 69.48097047859949,
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"formula_full": "Zn3 Cd1",
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},
{
"id": "jvasp-110120",
"created_at": "2022-09-04T14:38:03.135163Z",
"updated_at": "2022-09-04T14:38:03.135183Z",
"structure_string": "Zn3 Cd1 O4\n1.0\n3.331527 0.000000 0.000000\n-1.665764 2.885187 0.000000\n-0.000000 -0.000000 11.026302\nZn Cd O\n3 1 4\ndirect\n0.666668 0.333334 0.251213 Zn\n0.000000 0.000000 0.014571 Zn\n0.000000 0.000000 0.487641 Zn\n0.666668 0.333334 0.756386 Cd\n0.666668 0.333334 0.958459 O\n0.666668 0.333334 0.431294 O\n0.000000 0.000000 0.665631 O\n0.000000 0.000000 0.194805 O\n",
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"elements": [
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"density_atomic": 0.07548189587267086,
"volume": 105.98567918186721,
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"formula_full": "Zn3 Cd1 O4",
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"formula_anonymous": "AB3C4",
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"spacegroup": 156
},
{
"id": "jvasp-37639",
"created_at": "2022-09-04T14:38:03.870991Z",
"updated_at": "2022-09-04T14:38:03.871012Z",
"structure_string": "Zn3 Cd1 S4\n1.0\n5.551371 -0.000000 -0.000000\n-0.000000 5.551371 -0.000000\n-0.000000 0.000000 5.551371\nZn Cd S\n3 1 4\ndirect\n0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Cd\n0.262259 0.262259 0.262259 S\n0.737741 0.737741 0.262259 S\n0.262259 0.737741 0.737741 S\n0.737741 0.262259 0.737741 S\n",
"nsites": 8,
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"elements": [
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"density": 4.240610624006392,
"density_atomic": 0.04676158571555495,
"volume": 171.0805969810996,
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"formula_full": "Zn3 Cd1 S4",
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"spacegroup": 215
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{
"id": "jvasp-37614",
"created_at": "2022-09-04T14:37:48.570030Z",
"updated_at": "2022-09-04T14:37:48.570051Z",
"structure_string": "Zn3 Co1\n1.0\n3.730357 0.000000 -0.000000\n0.000000 3.730357 0.000000\n0.000000 0.000000 3.730357\nZn Co\n3 1\ndirect\n0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.000000 Co\n",
"nsites": 4,
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"elements": [
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"density": 8.162267690152786,
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"volume": 51.91001914209982,
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{
"id": "jvasp-79371",
"created_at": "2022-09-04T14:36:40.652775Z",
"updated_at": "2022-09-04T14:36:40.652792Z",
"structure_string": "Zn3 Co1\n1.0\n-1.815924 1.815924 3.955742\n1.815924 -1.815924 3.955742\n1.815924 1.815924 -3.955742\nZn Co\n3 1\ndirect\n0.749997 0.250000 0.499997 Zn\n0.250000 0.749997 0.499997 Zn\n0.499999 0.499999 0.000000 Zn\n0.000000 0.000000 0.000000 Co\n",
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"spacegroup": 139
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{
"id": "jvasp-19300",
"created_at": "2022-09-04T14:37:08.463683Z",
"updated_at": "2022-09-04T14:37:08.463713Z",
"structure_string": "Zn6 Co4 O14\n1.0\n5.076278 -0.000000 -0.000000\n-0.000000 4.848088 -1.307694\n-0.000000 -0.090590 9.304793\nZn Co O\n6 4 14\ndirect\n0.705053 0.749749 0.000000 Zn\n0.205053 0.250252 0.000000 Zn\n0.809668 0.558134 0.605160 Zn\n0.309668 0.441867 0.394840 Zn\n0.809668 0.952972 0.394840 Zn\n0.309668 0.047028 0.605160 Zn\n0.751921 0.348289 0.201659 Co\n0.251921 0.651711 0.798341 Co\n0.251921 0.853370 0.201659 Co\n0.751921 0.146631 0.798341 Co\n0.318652 0.630315 0.000000 O\n0.818652 0.369685 0.000000 O\n0.437866 0.143330 0.150727 O\n0.937866 0.856670 0.849273 O\n0.054530 0.570366 0.263271 O\n0.554530 0.429634 0.736729 O\n0.194165 0.064557 0.402278 O\n0.054530 0.307095 0.736729 O\n0.694165 0.337722 0.402278 O\n0.194165 0.662278 0.597722 O\n0.937866 0.007397 0.150727 O\n0.694165 0.935444 0.597722 O\n0.554530 0.692905 0.263271 O\n0.437866 0.992603 0.849273 O\n",
"nsites": 24,
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"elements": [
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"density": 6.1958229129398115,
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"volume": 228.39185554295824,
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"formula_full": "Zn6 Co4 O14",
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{
"id": "jvasp-110059",
"created_at": "2022-09-04T14:37:52.695383Z",
"updated_at": "2022-09-04T14:37:52.695403Z",
"structure_string": "Zn3 Cr1\n1.0\n3.767723 -0.000000 0.000000\n0.000000 3.767723 0.000000\n-0.000000 -0.000000 3.767723\nZn Cr\n3 1\ndirect\n-0.000000 0.500000 0.500000 Zn\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 -0.000000 Zn\n0.000000 0.000000 0.000000 Cr\n",
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"density": 7.706450508040702,
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"volume": 53.48560330757937,
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{
"id": "jvasp-19306",
"created_at": "2022-09-04T14:38:35.916526Z",
"updated_at": "2022-09-04T14:38:35.916555Z",
"structure_string": "Zn6 Cr4 O14\n1.0\n5.098859 0.000000 0.000000\n-0.000000 4.923794 -1.328114\n0.000000 -0.077150 9.505162\nZn Cr O\n6 4 14\ndirect\n0.718596 0.744945 0.000000 Zn\n0.218596 0.255054 0.000000 Zn\n0.793545 0.571215 0.600896 Zn\n0.293545 0.428785 0.399104 Zn\n0.793545 0.970317 0.399104 Zn\n0.293545 0.029683 0.600896 Zn\n0.754105 0.352768 0.202961 Cr\n0.254105 0.647231 0.797039 Cr\n0.254105 0.850193 0.202962 Cr\n0.754105 0.149806 0.797039 Cr\n0.319426 0.637092 0.000000 O\n0.819426 0.362907 0.000000 O\n0.437090 0.148143 0.154170 O\n0.937090 0.851857 0.845830 O\n0.071806 0.552092 0.254243 O\n0.571806 0.447908 0.745757 O\n0.184445 0.054462 0.404093 O\n0.071806 0.297849 0.745757 O\n0.684445 0.349632 0.404094 O\n0.184445 0.650367 0.595907 O\n0.937090 0.006027 0.154170 O\n0.684445 0.945537 0.595907 O\n0.571806 0.702150 0.254243 O\n0.437090 -0.006026 0.845830 O\n",
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"volume": 238.1115941565795,
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{
"id": "jvasp-92181",
"created_at": "2022-09-04T14:36:09.330538Z",
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"structure_string": "Zn3 Cr1 Se4\n1.0\n5.742132 -0.000000 0.000000\n0.000000 5.742132 -0.000000\n0.000000 0.000000 5.742132\nZn Cr Se\n3 1 4\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Cr\n0.748857 0.748857 0.251142 Se\n0.748857 0.251142 0.748857 Se\n0.251142 0.748857 0.748857 Se\n0.251142 0.251142 0.251142 Se\n",
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"formula_full": "Zn3 Cr1 Se4",
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{
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"created_at": "2022-09-04T14:36:04.824596Z",
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"structure_string": "Zn3 Cr1 Te4\n1.0\n6.184761 0.000000 0.000000\n-0.000000 6.184761 0.000000\n-0.000000 -0.000000 6.184761\nZn Cr Te\n3 1 4\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Cr\n0.749201 0.749201 0.250799 Te\n0.749201 0.250799 0.749201 Te\n0.250799 0.749201 0.749201 Te\n0.250799 0.250799 0.250799 Te\n",
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}