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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=4396",
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{
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"structure_string": "Ba4 Ga1 Si1\n1.0\n0.000000 4.919360 4.919360\n4.919360 0.000000 4.919360\n4.919360 4.919360 -0.000000\nBa Ga Si\n4 1 1\ndirect\n0.122801 0.625733 0.625733 Ba\n0.625733 0.625733 0.625733 Ba\n0.625733 0.122801 0.625733 Ba\n0.625733 0.625733 0.122801 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Si\n",
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{
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"structure_string": "Ba4 Ga1 Se1\n1.0\n0.000000 4.920028 4.920028\n4.920028 0.000000 4.920028\n4.920028 4.920028 -0.000000\nBa Ga Se\n4 1 1\ndirect\n0.122410 0.625863 0.625863 Ba\n0.625863 0.625863 0.625863 Ba\n0.625863 0.122410 0.625863 Ba\n0.625863 0.625863 0.122410 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Se\n",
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{
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"structure_string": "Ba4 Ga1 Sb1\n1.0\n-0.000000 4.964871 4.964871\n4.964871 -0.000000 4.964871\n4.964871 4.964871 -0.000000\nBa Ga Sb\n4 1 1\ndirect\n0.121983 0.626006 0.626006 Ba\n0.626006 0.626006 0.626006 Ba\n0.626006 0.121983 0.626006 Ba\n0.626006 0.626006 0.121983 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 6,
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"volume": 244.76758469758104,
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"formula_full": "Ba4 Ga1 Sb1",
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"formula_anonymous": "ABC4",
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{
"id": "jvasp-66404",
"created_at": "2022-09-04T14:35:42.098918Z",
"updated_at": "2022-09-04T14:35:42.098945Z",
"structure_string": "Ba4 Ga1 Ru1\n1.0\n0.000000 4.813178 4.813178\n4.813178 0.000000 4.813178\n4.813178 4.813178 -0.000000\nBa Ga Ru\n4 1 1\ndirect\n0.123872 0.625376 0.625376 Ba\n0.625376 0.625376 0.625376 Ba\n0.625376 0.123872 0.625376 Ba\n0.625376 0.625376 0.123872 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 6,
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"elements": [
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"chemical_system": "Ba-Ga-Ru",
"density": 5.361875762402938,
"density_atomic": 0.026904534716642423,
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"formula_full": "Ba4 Ga1 Ru1",
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"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-66399",
"created_at": "2022-09-04T14:36:19.729933Z",
"updated_at": "2022-09-04T14:36:19.729959Z",
"structure_string": "Ba4 Ga1 Rh1\n1.0\n-0.000000 4.817647 4.817647\n4.817647 0.000000 4.817647\n4.817647 4.817647 0.000000\nBa Ga Rh\n4 1 1\ndirect\n0.123771 0.625410 0.625410 Ba\n0.625410 0.625410 0.625410 Ba\n0.625410 0.123771 0.625410 Ba\n0.625410 0.625410 0.123771 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 6,
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"elements": [
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"volume": 223.632501069477,
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"formula_full": "Ba4 Ga1 Rh1",
"formula_reduced": "Ba4GaRh",
"formula_anonymous": "ABC4",
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},
{
"id": "jvasp-66286",
"created_at": "2022-09-04T14:35:44.603800Z",
"updated_at": "2022-09-04T14:35:44.603833Z",
"structure_string": "Ba4 Ga1 Pt1\n1.0\n0.000000 4.810199 4.810199\n4.810199 0.000000 4.810199\n4.810199 4.810199 -0.000000\nBa Ga Pt\n4 1 1\ndirect\n0.123253 0.625583 0.625583 Ba\n0.625583 0.625583 0.625583 Ba\n0.625583 0.123253 0.625583 Ba\n0.625583 0.625583 0.123253 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Pt\n",
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"formula_full": "Ba4 Ga1 Pt1",
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"spacegroup": 216
},
{
"id": "jvasp-64328",
"created_at": "2022-09-04T14:38:14.742936Z",
"updated_at": "2022-09-04T14:38:14.742961Z",
"structure_string": "Ba4 Ga1 Pd1\n1.0\n-0.000000 4.877887 4.877887\n4.877887 0.000000 4.877887\n4.877887 4.877887 -0.000000\nBa Ga Pd\n4 1 1\ndirect\n0.124575 0.625142 0.625142 Ba\n0.625142 0.625142 0.625142 Ba\n0.625142 0.124575 0.625142 Ba\n0.625142 0.625142 0.124575 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Pd\n",
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"elements": [
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],
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"volume": 232.12675574636825,
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"formula_full": "Ba4 Ga1 Pd1",
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"formula_anonymous": "ABC4",
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{
"id": "jvasp-64335",
"created_at": "2022-09-04T14:35:59.169601Z",
"updated_at": "2022-09-04T14:35:59.169641Z",
"structure_string": "Ba4 Ga1 Pb1\n1.0\n-0.000000 5.018679 5.018679\n5.018679 -0.000000 5.018679\n5.018679 5.018679 0.000000\nBa Ga Pb\n4 1 1\ndirect\n0.123651 0.625449 0.625449 Ba\n0.625449 0.625449 0.625449 Ba\n0.625449 0.123651 0.625449 Ba\n0.625449 0.625449 0.123651 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Pb\n",
"nsites": 6,
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"volume": 252.81233018562446,
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"formula_full": "Ba4 Ga1 Pb1",
"formula_reduced": "Ba4GaPb",
"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-64009",
"created_at": "2022-09-04T14:35:54.514177Z",
"updated_at": "2022-09-04T14:35:54.514197Z",
"structure_string": "Ba4 Ga1 P1\n1.0\n0.000000 4.871201 4.871201\n4.871201 0.000000 4.871201\n4.871201 4.871201 0.000000\nBa Ga P\n4 1 1\ndirect\n0.121613 0.626129 0.626129 Ba\n0.626129 0.626129 0.626129 Ba\n0.626129 0.121613 0.626129 Ba\n0.626129 0.626129 0.121613 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 P\n",
"nsites": 6,
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"elements": [
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"formula_full": "Ba4 Ga1 P1",
"formula_reduced": "Ba4GaP",
"formula_anonymous": "ABC4",
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"spacegroup": 216
},
{
"id": "jvasp-66452",
"created_at": "2022-09-04T14:35:47.323961Z",
"updated_at": "2022-09-04T14:35:47.323993Z",
"structure_string": "Ba4 Ga1 Mo1\n1.0\n-0.000000 4.819653 4.819653\n4.819653 -0.000000 4.819653\n4.819653 4.819653 0.000000\nBa Ga Mo\n4 1 1\ndirect\n0.124155 0.625282 0.625282 Ba\n0.625282 0.625282 0.625282 Ba\n0.625282 0.124155 0.625282 Ba\n0.625282 0.625282 0.124155 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Mo\n",
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"formula_full": "Ba4 Ga1 Mo1",
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},
{
"id": "jvasp-66422",
"created_at": "2022-09-04T14:35:56.650003Z",
"updated_at": "2022-09-04T14:35:56.650018Z",
"structure_string": "Ba4 Ga1 Ir1\n1.0\n-0.000000 4.760485 4.760485\n4.760485 0.000000 4.760485\n4.760485 4.760485 0.000000\nBa Ga Ir\n4 1 1\ndirect\n0.122818 0.625727 0.625727 Ba\n0.625727 0.625727 0.625727 Ba\n0.625727 0.122818 0.625727 Ba\n0.625727 0.625727 0.122818 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 6,
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"formula_full": "Ba4 Ga1 Ir1",
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{
"id": "jvasp-64141",
"created_at": "2022-09-04T14:37:52.473367Z",
"updated_at": "2022-09-04T14:37:52.473378Z",
"structure_string": "Ba4 Ga1 Hg1\n1.0\n-0.000000 5.011517 5.011517\n5.011517 -0.000000 5.011517\n5.011517 5.011517 -0.000000\nBa Ga Hg\n4 1 1\ndirect\n0.125884 0.624706 0.624706 Ba\n0.624706 0.624706 0.624706 Ba\n0.624706 0.125884 0.624706 Ba\n0.624706 0.624706 0.125884 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Hg\n",
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"volume": 251.73153229392952,
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"formula_anonymous": "ABC4",
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