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"structure_string": "Ba4 Cr1 Cd1\n1.0\n0.000000 5.075694 5.075694\n5.075694 0.000000 5.075694\n5.075694 5.075694 -0.000000\nBa Cr Cd\n4 1 1\ndirect\n0.125559 0.624813 0.624813 Ba\n0.624813 0.624813 0.624813 Ba\n0.624813 0.125559 0.624813 Ba\n0.624813 0.624813 0.125559 Ba\n0.000000 0.000000 0.000000 Cr\n0.250000 0.250000 0.250000 Cd\n",
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{
"id": "jvasp-64709",
"created_at": "2022-09-04T14:36:16.891130Z",
"updated_at": "2022-09-04T14:36:16.891149Z",
"structure_string": "Ba4 Be1 Br1\n1.0\n-0.000000 5.074924 5.074924\n5.074924 0.000000 5.074924\n5.074924 5.074924 0.000000\nBa Be Br\n4 1 1\ndirect\n0.125054 0.624981 0.624981 Ba\n0.624981 0.624981 0.624981 Ba\n0.624981 0.125054 0.624981 Ba\n0.624981 0.624981 0.125054 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Br\n",
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"elements": [
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"density": 4.054186551975953,
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"formula_full": "Ba4 Be1 Br1",
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{
"id": "jvasp-1267",
"created_at": "2022-09-04T14:36:58.972918Z",
"updated_at": "2022-09-04T14:36:58.972937Z",
"structure_string": "Ba1 Te1\n1.0\n4.309558 0.000000 2.488124\n1.436519 4.063090 2.488124\n0.000000 0.000000 4.976248\nBa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.499999 Te\n",
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"elements": [
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{
"id": "jvasp-50956",
"created_at": "2022-09-04T14:36:47.138392Z",
"updated_at": "2022-09-04T14:36:47.138416Z",
"structure_string": "Ba2 Sr2 I8\n1.0\n-1.812590 0.000000 8.475581\n3.242012 -7.427318 4.254470\n3.242012 7.427318 4.254470\nBa Sr I\n2 2 8\ndirect\n0.750000 0.233183 0.266817 Ba\n0.250000 0.766817 0.733182 Ba\n0.250000 0.381739 0.118261 Sr\n0.750000 0.618260 0.881739 Sr\n0.257212 0.997563 0.119907 I\n0.930508 0.763364 0.126797 I\n0.430508 0.626797 0.263364 I\n0.242789 0.380092 0.502437 I\n0.757212 0.619907 0.497563 I\n0.569492 0.373202 0.736635 I\n0.069493 0.236635 0.873202 I\n0.742789 0.002437 0.880093 I\n",
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{
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"created_at": "2022-09-04T14:38:39.645715Z",
"updated_at": "2022-09-04T14:38:39.645736Z",
"structure_string": "Rb1 Ag1 Se1\n1.0\n5.710068 2.886240 0.000000\n2.173164 6.017084 0.000000\n0.000000 0.000000 4.651527\nRb Ag Se\n1 1 1\ndirect\n-0.194120 0.119018 0.000000 Rb\n0.529035 -0.158030 0.000000 Ag\n0.094863 0.407866 0.000000 Se\n",
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"volume": 130.6413264557646,
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{
"id": "jvasp-64840",
"created_at": "2022-09-04T14:36:14.563720Z",
"updated_at": "2022-09-04T14:36:14.563738Z",
"structure_string": "Ba4 Sc1 Cu1\n1.0\n0.000000 5.073649 5.073649\n5.073649 -0.000000 5.073649\n5.073649 5.073649 -0.000000\nBa Sc Cu\n4 1 1\ndirect\n0.125807 0.624731 0.624731 Ba\n0.624731 0.624731 0.624731 Ba\n0.624731 0.125807 0.624731 Ba\n0.624731 0.624731 0.125807 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Cu\n",
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{
"id": "jvasp-64148",
"created_at": "2022-09-04T14:36:00.238903Z",
"updated_at": "2022-09-04T14:36:00.238940Z",
"structure_string": "Ba4 Sc1 Pb1\n1.0\n0.000000 5.073176 5.073176\n5.073176 0.000000 5.073176\n5.073176 5.073176 0.000000\nBa Sc Pb\n4 1 1\ndirect\n0.127034 0.624322 0.624322 Ba\n0.624322 0.624322 0.624322 Ba\n0.624322 0.127034 0.624322 Ba\n0.624322 0.624322 0.127034 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Pb\n",
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{
"id": "jvasp-64862",
"created_at": "2022-09-04T14:35:44.503988Z",
"updated_at": "2022-09-04T14:35:44.504018Z",
"structure_string": "Ba4 Tl1 Zn1\n1.0\n0.000000 5.073173 5.073173\n5.073173 -0.000000 5.073173\n5.073173 5.073173 0.000000\nBa Tl Zn\n4 1 1\ndirect\n0.126026 0.624658 0.624658 Ba\n0.624658 0.624658 0.624658 Ba\n0.624658 0.126026 0.624658 Ba\n0.624658 0.624658 0.126026 Ba\n0.250000 0.250000 0.250000 Tl\n0.000000 0.000000 0.000000 Zn\n",
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{
"id": "jvasp-99677",
"created_at": "2022-09-04T14:36:34.781424Z",
"updated_at": "2022-09-04T14:36:34.781450Z",
"structure_string": "K2 Tl1 Ga1 I6\n1.0\n7.366669 -0.000000 4.253148\n2.455556 6.945361 4.253148\n-0.000000 -0.000000 8.506296\nK Tl Ga I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Ga\n0.766742 0.233258 0.233259 I\n0.233259 0.233258 0.766742 I\n0.233259 0.766741 0.766742 I\n0.233259 0.766741 0.233259 I\n0.766742 0.233258 0.766742 I\n0.766742 0.766741 0.233259 I\n",
"nsites": 10,
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{
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"created_at": "2022-09-04T14:36:04.597932Z",
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"structure_string": "Ba4 Mo1 Br1\n1.0\n0.000000 5.072560 5.072560\n5.072560 0.000000 5.072560\n5.072560 5.072560 0.000000\nBa Mo Br\n4 1 1\ndirect\n0.123762 0.625413 0.625413 Ba\n0.625413 0.625413 0.625413 Ba\n0.625413 0.123762 0.625413 Ba\n0.625413 0.625413 0.123762 Ba\n0.000000 0.000000 0.000000 Mo\n0.250000 0.250000 0.250000 Br\n",
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