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{
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{
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"created_at": "2022-09-04T14:36:17.351530Z",
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"structure_string": "Ba4 Zn1 Bi1\n1.0\n-0.000000 5.048293 5.048293\n5.048293 0.000000 5.048293\n5.048293 5.048293 -0.000000\nBa Zn Bi\n4 1 1\ndirect\n0.128806 0.623731 0.623731 Ba\n0.623731 0.623731 0.623731 Ba\n0.623731 0.128806 0.623731 Ba\n0.623731 0.623731 0.128806 Ba\n0.000000 0.000000 0.000000 Zn\n0.250000 0.250000 0.250000 Bi\n",
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{
"id": "jvasp-65543",
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"structure_string": "Ba1 Zn1 Bi2\n1.0\n4.257451 -0.000000 0.000000\n-0.000000 4.257451 0.000000\n0.000000 -0.000000 7.169769\nBa Zn Bi\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.500000 0.000000 Zn\n0.000000 0.000000 0.789650 Bi\n0.000000 0.000000 0.210350 Bi\n",
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{
"id": "jvasp-13814",
"created_at": "2022-09-04T14:37:46.668639Z",
"updated_at": "2022-09-04T14:37:46.668669Z",
"structure_string": "Ba2 Zn2 Bi4\n1.0\n4.596171 0.000000 -0.989568\n-0.213056 4.591231 -0.989568\n0.239254 0.250615 12.279786\nBa Zn Bi\n2 2 4\ndirect\n0.879013 0.879014 0.758029 Ba\n0.120985 0.120985 0.241970 Ba\n0.249999 0.749999 0.500000 Zn\n0.749999 0.249999 0.500000 Zn\n-0.000000 0.500000 -0.000000 Bi\n0.678111 0.678112 0.356224 Bi\n0.500000 0.000000 -0.000000 Bi\n0.321887 0.321887 0.643775 Bi\n",
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"density": 7.885667439003056,
"density_atomic": 0.030603411727359427,
"volume": 261.408762894498,
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"formula_full": "Ba2 Zn2 Bi4",
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{
"id": "jvasp-69295",
"created_at": "2022-09-04T14:36:13.111607Z",
"updated_at": "2022-09-04T14:36:13.111632Z",
"structure_string": "Ba1 Zn1 Bi2\n1.0\n4.277388 0.000000 0.000000\n0.000000 4.277521 0.000000\n0.000000 0.000000 7.346220\nBa Zn Bi\n1 1 2\ndirect\n0.500000 0.500000 0.735119 Ba\n0.000000 0.000000 0.466562 Zn\n0.000000 0.000000 0.060519 Bi\n0.500000 0.500000 0.237801 Bi\n",
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{
"id": "jvasp-69051",
"created_at": "2022-09-04T14:36:00.204227Z",
"updated_at": "2022-09-04T14:36:00.204249Z",
"structure_string": "Ba2 Zn1 Bi1\n1.0\n-0.000000 4.213849 4.213849\n4.213849 0.000000 4.213849\n4.213849 4.213849 -0.000000\nBa Zn Bi\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Bi\n",
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{
"id": "jvasp-18627",
"created_at": "2022-09-04T14:36:46.084493Z",
"updated_at": "2022-09-04T14:36:46.084508Z",
"structure_string": "Ba2 Zn2 Bi4\n1.0\n4.596168 0.000000 -0.989567\n-0.213056 4.591227 -0.989567\n0.239267 0.250628 12.279837\nBa Zn Bi\n2 2 4\ndirect\n0.879015 0.879016 0.758030 Ba\n0.120985 0.120985 0.241970 Ba\n0.250000 0.750001 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n-0.000000 0.500000 -0.000000 Bi\n0.678113 0.678113 0.356225 Bi\n0.500000 0.000000 -0.000000 Bi\n0.321887 0.321888 0.643774 Bi\n",
"nsites": 8,
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"formula_full": "Ba2 Zn2 Bi4",
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{
"id": "jvasp-69218",
"created_at": "2022-09-04T14:36:00.351421Z",
"updated_at": "2022-09-04T14:36:00.351447Z",
"structure_string": "Ba1 Zr1 Bi2\n1.0\n6.052515 0.000000 -0.000000\n0.000000 6.052515 -0.000000\n0.000000 -0.000000 3.424497\nBa Zr Bi\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.500000 Zr\n0.000000 0.500000 0.000000 Bi\n0.500000 0.000000 0.000000 Bi\n",
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"spacegroup": 123
},
{
"id": "jvasp-64772",
"created_at": "2022-09-04T14:36:15.857210Z",
"updated_at": "2022-09-04T14:36:15.857237Z",
"structure_string": "Ba4 Zr1 Bi1\n1.0\n0.000000 5.020394 5.020394\n5.020394 0.000000 5.020394\n5.020394 5.020394 0.000000\nBa Zr Bi\n4 1 1\ndirect\n0.126784 0.624405 0.624405 Ba\n0.624405 0.624405 0.624405 Ba\n0.624405 0.126784 0.624405 Ba\n0.624405 0.624405 0.126784 Ba\n0.000000 0.000000 0.000000 Zr\n0.250000 0.250000 0.250000 Bi\n",
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"spacegroup": 216
},
{
"id": "jvasp-68949",
"created_at": "2022-09-04T14:36:07.561837Z",
"updated_at": "2022-09-04T14:36:07.561854Z",
"structure_string": "Ba2 Zr1 Bi1\n1.0\n0.000000 4.258295 4.258295\n4.258295 -0.000000 4.258295\n4.258295 4.258295 0.000000\nBa Zr Bi\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500001 0.500001 0.500001 Zr\n0.000000 0.000000 0.000000 Bi\n",
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},
{
"id": "jvasp-66085",
"created_at": "2022-09-04T14:36:14.552255Z",
"updated_at": "2022-09-04T14:36:14.552278Z",
"structure_string": "Ba1 Zr1 Bi1\n1.0\n0.000000 3.937704 3.937704\n3.937704 0.000000 3.937704\n3.937704 3.937704 0.000000\nBa Zr Bi\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.499999 0.499999 0.499999 Zr\n0.000000 0.000000 0.000000 Bi\n",
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{
"id": "jvasp-12764",
"created_at": "2022-09-04T14:38:11.194538Z",
"updated_at": "2022-09-04T14:38:11.194552Z",
"structure_string": "Ba4 Br8\n1.0\n4.959687 -0.000000 0.000000\n0.000000 8.274817 0.000000\n0.000000 0.000000 9.990619\nBa Br\n4 8\ndirect\n0.250000 0.748109 0.619302 Ba\n0.750000 0.251892 0.380698 Ba\n0.250000 0.248108 0.880698 Ba\n0.750000 0.751892 0.119302 Ba\n0.250000 0.529210 0.329412 Br\n0.750000 0.470790 0.670588 Br\n0.250000 0.029210 0.170588 Br\n0.750000 0.970791 0.829412 Br\n0.750000 0.856260 0.430457 Br\n0.250000 0.143740 0.569543 Br\n0.750000 0.356260 0.069543 Br\n0.250000 0.643740 0.930457 Br\n",
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"formula_full": "Ba4 Br8",
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"spacegroup": 62
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}