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{
"id": "mp-1111640",
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"structure_string": "K2 Na1 In1 Br6\n1.0\n0.000000 5.597386 5.597386\n5.597386 0.000000 5.597386\n5.597386 5.597386 0.000000\nK Na In Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 In\n0.758808 0.241192 0.241192 Br\n0.241192 0.241192 0.758808 Br\n0.241192 0.758808 0.758808 Br\n0.241192 0.758808 0.241192 Br\n0.758808 0.241192 0.758808 Br\n0.758808 0.758808 0.241192 Br\n",
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{
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"structure_string": "K2 Na1 Lu1 Cl6\n1.0\n0.000000 5.307538 5.307538\n5.307538 0.000000 5.307538\n5.307538 5.307538 0.000000\nK Na Lu Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Lu\n0.757748 0.242252 0.242252 Cl\n0.242252 0.242252 0.757748 Cl\n0.242252 0.757748 0.757748 Cl\n0.242252 0.757748 0.242252 Cl\n0.757748 0.242252 0.757748 Cl\n0.757748 0.757748 0.242252 Cl\n",
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"formula_full": "K2 Na1 Lu1 Cl6",
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{
"id": "mp-1111638",
"created_at": "2022-09-04T14:42:14.179257Z",
"structure_string": "K2 Na1 Mn1 F6\n1.0\n5.971836 0.000000 0.000000\n2.985918 5.171762 0.000000\n2.985918 1.723921 4.875984\nK Na Mn F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Mn\n0.231544 0.768456 0.231544 F\n0.768456 0.768456 0.231544 F\n0.768456 0.231544 0.768456 F\n0.768456 0.231544 0.231544 F\n0.231544 0.768456 0.768456 F\n0.231544 0.231544 0.768456 F\n",
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"volume": 150.5943489191441,
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"formula_full": "K2 Na1 Mn1 F6",
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"formula_anonymous": "ABC2D6",
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"updated_at": "2021-11-28T01:35:38.665000Z",
"spacegroup": 225
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{
"id": "mp-1111636",
"created_at": "2022-09-04T14:41:52.604473Z",
"structure_string": "Rb2 Er1 Ag1 Cl6\n1.0\n0.000000 5.367039 5.367039\n5.367039 0.000000 5.367039\n5.367039 5.367039 0.000000\nRb Er Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Er\n0.500000 0.500000 0.500000 Ag\n0.756554 0.243446 0.243446 Cl\n0.243446 0.243446 0.756554 Cl\n0.243446 0.756554 0.756554 Cl\n0.243446 0.756554 0.243446 Cl\n0.756554 0.243446 0.756554 Cl\n0.756554 0.756554 0.243446 Cl\n",
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"formula_full": "Rb2 Er1 Ag1 Cl6",
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{
"id": "mp-1111634",
"created_at": "2022-09-04T14:40:02.822713Z",
"structure_string": "Rb2 In1 Ag1 Cl6\n1.0\n0.000000 5.282861 5.282861\n5.282861 0.000000 5.282861\n5.282861 5.282861 0.000000\nRb In Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Ag\n0.757979 0.242021 0.242021 Cl\n0.242021 0.242021 0.757979 Cl\n0.242021 0.757979 0.757979 Cl\n0.242021 0.757979 0.242021 Cl\n0.757979 0.242021 0.757979 Cl\n0.757979 0.757979 0.242021 Cl\n",
"nsites": 10,
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"formula_full": "Rb2 In1 Ag1 Cl6",
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"energy": -35.761866049999995,
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"updated_at": "2021-11-28T01:35:04.838000Z",
"spacegroup": 225
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{
"id": "mp-1111632",
"created_at": "2022-09-04T14:39:08.794222Z",
"structure_string": "Rb2 Lu1 Ag1 Cl6\n1.0\n0.000000 5.332740 5.332740\n5.332740 0.000000 5.332740\n5.332740 5.332740 0.000000\nRb Lu Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Lu\n0.500000 0.500000 0.500000 Ag\n0.758070 0.241930 0.241930 Cl\n0.241930 0.241930 0.758070 Cl\n0.241930 0.758070 0.758070 Cl\n0.241930 0.758070 0.241930 Cl\n0.758070 0.241930 0.758070 Cl\n0.758070 0.758070 0.241930 Cl\n",
"nsites": 10,
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"density": 3.6488896328522316,
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"formula_full": "Rb2 Lu1 Ag1 Cl6",
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"updated_at": "2021-11-28T01:34:41.771000Z",
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{
"id": "mp-1111629",
"created_at": "2022-09-04T14:39:22.191496Z",
"structure_string": "Rb2 Tl1 Ag1 Cl6\n1.0\n0.000000 5.329731 5.329731\n5.329731 0.000000 5.329731\n5.329731 5.329731 0.000000\nRb Tl Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Tl\n0.500000 0.500000 0.500000 Ag\n0.751277 0.248723 0.248723 Cl\n0.248723 0.248723 0.751277 Cl\n0.248723 0.751277 0.751277 Cl\n0.248723 0.751277 0.248723 Cl\n0.751277 0.248723 0.751277 Cl\n0.751277 0.751277 0.248723 Cl\n",
"nsites": 10,
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"elements": [
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],
"chemical_system": "Ag-Cl-Rb-Tl",
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"formula_full": "Rb2 Tl1 Ag1 Cl6",
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{
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"created_at": "2022-09-04T14:41:34.540387Z",
"structure_string": "Rb2 Tm1 Ag1 Cl6\n1.0\n0.000000 5.348045 5.348045\n5.348045 0.000000 5.348045\n5.348045 5.348045 0.000000\nRb Tm Ag Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.500000 Ag\n0.757140 0.242860 0.242860 Cl\n0.242860 0.242860 0.757140 Cl\n0.242860 0.757140 0.757140 Cl\n0.242860 0.757140 0.242860 Cl\n0.757140 0.242860 0.757140 Cl\n0.757140 0.757140 0.242860 Cl\n",
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{
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"structure_string": "K2 Na1 Pd1 F6\n1.0\n0.000000 4.302965 4.302965\n4.302965 0.000000 4.302965\n4.302965 4.302965 0.000000\nK Na Pd F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Pd\n0.238744 0.238744 0.761256 F\n0.238744 0.761256 0.761256 F\n0.761256 0.761256 0.238744 F\n0.238744 0.761256 0.238744 F\n0.761256 0.238744 0.761256 F\n0.761256 0.238744 0.238744 F\n",
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{
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"structure_string": "Rb2 As1 Au1 Cl6\n1.0\n0.000000 5.221312 5.221312\n5.221312 0.000000 5.221312\n5.221312 5.221312 0.000000\nRb As Au Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 As\n0.500000 0.500000 0.500000 Au\n0.757878 0.242122 0.242122 Cl\n0.242122 0.242122 0.757878 Cl\n0.242122 0.757878 0.757878 Cl\n0.242122 0.757878 0.242122 Cl\n0.757878 0.242122 0.757878 Cl\n0.757878 0.757878 0.242122 Cl\n",
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"spacegroup": 225
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{
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"created_at": "2022-09-04T14:40:01.996079Z",
"structure_string": "K2 Na1 Tb1 Cl6\n1.0\n0.000000 5.375459 5.375459\n5.375459 0.000000 5.375459\n5.375459 5.375459 0.000000\nK Na Tb Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Tb\n0.754505 0.245495 0.245495 Cl\n0.245495 0.245495 0.754505 Cl\n0.245495 0.754505 0.754505 Cl\n0.245495 0.754505 0.245495 Cl\n0.754505 0.245495 0.754505 Cl\n0.754505 0.754505 0.245495 Cl\n",
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"formula_full": "K2 Na1 Tb1 Cl6",
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{
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"structure_string": "K2 Na1 Sc1 Cl6\n1.0\n0.000000 5.223073 5.223073\n5.223073 0.000000 5.223073\n5.223073 5.223073 0.000000\nK Na Sc Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.761508 0.238492 0.238492 Cl\n0.238492 0.238492 0.761508 Cl\n0.238492 0.761508 0.761508 Cl\n0.238492 0.761508 0.238492 Cl\n0.761508 0.238492 0.761508 Cl\n0.761508 0.761508 0.238492 Cl\n",
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]
}