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{
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{
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{
"id": "mp-962069",
"created_at": "2022-09-04T14:47:21.739359Z",
"structure_string": "Li1 Ag1 Te1\n1.0\n0.000000 3.198888 3.198888\n3.198888 0.000000 3.198888\n3.198888 3.198888 0.000000\nLi Ag Te\n1 1 1\ndirect\n0.750000 0.750000 0.750000 Li\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Te\n",
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{
"id": "mp-1100444",
"created_at": "2022-09-04T14:47:21.745535Z",
"structure_string": "Mg8 Si14\n1.0\n2.010561 14.797419 0.000000\n-2.010561 14.797419 0.000000\n0.000000 0.550391 6.807664\nMg Si\n8 14\ndirect\n0.983159 0.983159 0.058207 Mg\n0.189081 0.189081 0.320829 Mg\n0.765759 0.765759 0.128006 Mg\n0.616461 0.616461 0.526828 Mg\n0.029252 0.029252 0.561289 Mg\n0.835951 0.835951 0.568937 Mg\n0.732422 0.732422 0.631831 Mg\n0.653998 0.653998 0.017666 Mg\n0.467222 0.467222 0.405512 Si\n0.461921 0.461921 0.762704 Si\n0.913777 0.913777 0.784949 Si\n0.922325 0.922325 0.395469 Si\n0.165201 0.165201 0.707103 Si\n0.220954 0.220954 0.940467 Si\n0.334191 0.334191 0.139422 Si\n0.541439 0.541439 0.862648 Si\n0.095854 0.095854 0.236450 Si\n0.879753 0.879753 0.115303 Si\n0.280124 0.280124 0.420973 Si\n0.542315 0.542315 0.228651 Si\n0.091880 0.091880 0.877678 Si\n0.299181 0.299181 0.812778 Si\n",
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{
"id": "mp-1017983",
"created_at": "2022-09-04T14:47:21.750273Z",
"structure_string": "Ti1 Mo3\n1.0\n-1.588482 2.223687 4.489162\n1.588482 -2.223687 4.489162\n1.588482 2.223687 -4.489162\nTi Mo\n1 3\ndirect\n0.500000 0.000000 0.500000 Ti\n0.755968 0.755968 0.000000 Mo\n0.244032 0.244032 0.000000 Mo\n0.000000 0.500000 0.500000 Mo\n",
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"formula_full": "Ti1 Mo3",
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"updated_at": "2021-11-28T01:38:07.078000Z",
"spacegroup": 71
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{
"id": "mp-1184739",
"created_at": "2022-09-04T14:47:21.751822Z",
"structure_string": "Ho1 Cd1 Rh2\n1.0\n0.000000 3.317671 3.317671\n3.317671 0.000000 3.317671\n3.317671 3.317671 0.000000\nHo Cd Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Ho\n0.249999 0.249999 0.249999 Cd\n0.000000 0.000000 0.000000 Rh\n0.500000 0.500000 0.500000 Rh\n",
"nsites": 4,
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"density": 10.985079929622929,
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{
"id": "mp-557543",
"created_at": "2022-09-04T14:47:21.758415Z",
"structure_string": "K6 Lu2 Si4 O14\n1.0\n2.882578 -4.992771 0.000000\n2.882578 4.992771 0.000000\n0.000000 0.000000 14.064230\nK Lu Si O\n6 2 4 14\ndirect\n0.666667 0.333333 0.908378 K\n0.333333 0.666667 0.091622 K\n0.666667 0.333333 0.591622 K\n0.333333 0.666667 0.408378 K\n0.000000 0.000000 0.750000 K\n0.000000 0.000000 0.250000 K\n0.000000 0.000000 0.000000 Lu\n0.000000 0.000000 0.500000 Lu\n0.666667 0.333333 0.368747 Si\n0.666667 0.333333 0.131253 Si\n0.333333 0.666667 0.868747 Si\n0.333333 0.666667 0.631253 Si\n0.177459 0.354919 0.594768 O\n0.822541 0.177459 0.094768 O\n0.645081 0.822541 0.905232 O\n0.822541 0.645081 0.094768 O\n0.177459 0.822541 0.905232 O\n0.822541 0.645081 0.405232 O\n0.822541 0.177459 0.405232 O\n0.177459 0.822541 0.594768 O\n0.645081 0.822541 0.594768 O\n0.354919 0.177459 0.094768 O\n0.666667 0.333333 0.250000 O\n0.177459 0.354919 0.905232 O\n0.354919 0.177459 0.405232 O\n0.333333 0.666667 0.750000 O\n",
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{
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"structure_string": "Rb2 Ag1 Bi1 Cl6\n1.0\n0.000000 5.438895 5.438895\n5.438895 0.000000 5.438895\n5.438895 5.438895 0.000000\nRb Ag Bi Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Bi\n0.750025 0.249975 0.249975 Cl\n0.249975 0.249975 0.750025 Cl\n0.249975 0.750025 0.750025 Cl\n0.249975 0.750025 0.249975 Cl\n0.750025 0.249975 0.750025 Cl\n0.750025 0.750025 0.249975 Cl\n",
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{
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{
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"structure_string": "Cs2 Sc1 In1 Br6\n1.0\n0.000000 5.842519 5.842519\n5.842519 0.000000 5.842519\n5.842519 5.842519 0.000000\nCs Sc In Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Cs\n0.250000 0.250000 0.250000 Cs\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 In\n0.771242 0.228758 0.228758 Br\n0.228758 0.228758 0.771242 Br\n0.228758 0.771242 0.771242 Br\n0.228758 0.771242 0.228758 Br\n0.771242 0.228758 0.771242 Br\n0.771242 0.771242 0.228758 Br\n",
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{
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{
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"structure_string": "Li4 Fe2 Co3 Sn3 O16\n1.0\n5.997634 -0.030091 0.045854\n-3.024737 5.217127 -0.011606\n0.073068 0.020508 9.624499\nLi Fe Co Sn O\n4 2 3 3 16\ndirect\n0.352063 0.674447 0.884841 Li\n0.957869 0.978444 0.992001 Li\n0.972888 0.984502 0.502652 Li\n0.675599 0.337318 0.397886 Li\n0.338545 0.673865 0.496703 Fe\n0.679173 0.341934 0.988704 Fe\n0.659815 0.830119 0.215782 Co\n0.831424 0.659326 0.714208 Co\n0.830962 0.169601 0.712699 Co\n0.170912 0.831235 0.215064 Sn\n0.170741 0.339455 0.214058 Sn\n0.339294 0.170132 0.714911 Sn\n0.154644 0.831799 0.597584 O\n0.036745 0.518399 0.348443 O\n0.354471 0.677100 0.099839 O\n0.978299 0.989773 0.315795 O\n0.977307 0.990010 0.806924 O\n0.145154 0.320554 0.599820 O\n0.495789 0.964364 0.339818 O\n0.494945 0.530891 0.340186 O\n0.321137 0.158975 0.086529 O\n0.671719 0.841843 0.612553 O\n0.536843 0.493454 0.839427 O\n0.543489 0.042973 0.836904 O\n0.689286 0.343038 0.609061 O\n0.829851 0.671128 0.100069 O\n0.962345 0.478018 0.825416 O\n0.828693 0.157603 0.099959 O\n",
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"is_gap_direct": false,
"is_magnetic": true,
"total_magnetization": 10.9999976,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:01.707000Z",
"spacegroup": 8
}
]
}