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{
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"results": [
{
"id": "mp-1023047",
"created_at": "2022-09-04T14:45:52.736760Z",
"structure_string": "Ba2 Mg12 Mn2\n1.0\n5.256602 0.000000 0.000000\n0.000000 6.790343 0.000000\n0.000000 0.000000 11.798228\nBa Mg Mn\n2 12 2\ndirect\n0.500000 0.500000 0.165783 Ba\n0.500000 0.000000 0.665783 Ba\n0.500000 0.258098 0.419937 Mg\n0.500000 0.741902 0.419937 Mg\n0.000000 0.778783 0.081287 Mg\n0.000000 0.221217 0.081287 Mg\n0.000000 0.000000 0.327032 Mg\n0.000000 0.500000 0.347498 Mg\n0.500000 0.758098 0.919937 Mg\n0.500000 0.241902 0.919937 Mg\n0.000000 0.278783 0.581287 Mg\n0.000000 0.721217 0.581287 Mg\n0.000000 0.500000 0.827032 Mg\n0.000000 0.000000 0.847498 Mg\n0.500000 0.000000 0.157235 Mn\n0.500000 0.500000 0.657235 Mn\n",
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{
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{
"id": "mp-569613",
"created_at": "2022-09-04T14:48:29.232771Z",
"structure_string": "Ba4 P14 Cl2\n1.0\n6.929669 0.000000 0.000000\n0.000000 6.421565 0.000000\n0.000000 1.083365 11.830190\nBa P Cl\n4 14 2\ndirect\n0.250000 0.229264 0.954338 Ba\n0.250000 0.432757 0.346937 Ba\n0.750000 0.770736 0.045662 Ba\n0.750000 0.567243 0.653063 Ba\n0.250000 0.008903 0.550509 P\n0.993970 0.117018 0.195238 P\n0.750000 0.321563 0.222366 P\n0.250000 0.674467 0.593477 P\n0.419701 0.144717 0.686887 P\n0.080299 0.144717 0.686887 P\n0.919701 0.855283 0.313113 P\n0.006030 0.882982 0.804762 P\n0.250000 0.678437 0.777634 P\n0.493970 0.882982 0.804762 P\n0.580299 0.855283 0.313113 P\n0.750000 0.325533 0.406523 P\n0.506030 0.117018 0.195238 P\n0.750000 0.991097 0.449491 P\n0.750000 0.365041 0.911013 Cl\n0.250000 0.634959 0.088987 Cl\n",
"nsites": 20,
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"elements": [
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],
"chemical_system": "Ba-Cl-P",
"density": 3.3241562612903492,
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"formula_full": "Ba4 P14 Cl2",
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},
{
"id": "mp-8279",
"created_at": "2022-09-04T14:39:29.536661Z",
"structure_string": "Ba1 Cd2 P2\n1.0\n2.231001 -3.864207 0.000000\n2.231001 3.864207 0.000000\n0.000000 0.000000 7.633084\nBa Cd P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.369122 Cd\n0.333333 0.666667 0.630878 Cd\n0.666667 0.333333 0.733469 P\n0.333333 0.666667 0.266531 P\n",
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],
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"formula_full": "Ba1 Cd2 P2",
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},
{
"id": "mp-1069712",
"created_at": "2022-09-04T14:40:26.664276Z",
"structure_string": "Ba1 Cd2 Ge2\n1.0\n-2.384968 2.384968 5.784542\n2.384968 -2.384968 5.784542\n2.384968 2.384968 -5.784542\nBa Cd Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.750000 0.250000 0.500000 Cd\n0.250000 0.750000 0.500000 Cd\n0.612172 0.612172 0.000000 Ge\n0.387828 0.387828 0.000000 Ge\n",
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"updated_at": "2021-11-28T01:34:56.380000Z",
"spacegroup": 139
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{
"id": "mp-1229007",
"created_at": "2022-09-04T14:48:27.996355Z",
"structure_string": "Ag1 Sb1 Te1 Se1\n1.0\n4.117145 0.000000 0.000000\n0.000000 4.117145 0.000000\n0.000000 0.000000 6.211630\nAg Sb Te Se\n1 1 1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Sb\n0.500000 0.500000 0.000000 Te\n0.000000 0.000000 0.500000 Se\n",
"nsites": 4,
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],
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"density": 6.878996782445512,
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"volume": 105.29261306507541,
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"formula_full": "Ag1 Sb1 Te1 Se1",
"formula_reduced": "AgSbTeSe",
"formula_anonymous": "ABCD",
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{
"id": "mp-754673",
"created_at": "2022-09-04T14:46:27.556284Z",
"structure_string": "Er6 Te2 Ru1\n1.0\n4.135870 -7.163537 0.000000\n4.135870 7.163537 0.000000\n0.000000 0.000000 3.998156\nEr Te Ru\n6 2 1\ndirect\n0.000000 0.608193 0.500000 Er\n0.239179 0.000000 0.000000 Er\n0.000000 0.239179 0.000000 Er\n0.608193 0.000000 0.500000 Er\n0.391807 0.391807 0.500000 Er\n0.760821 0.760821 0.000000 Er\n0.333333 0.666667 0.000000 Te\n0.666667 0.333333 0.000000 Te\n0.000000 0.000000 0.500000 Ru\n",
"nsites": 9,
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"density": 9.531202145391756,
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"formula_full": "Er6 Te2 Ru1",
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{
"id": "mp-1207529",
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"structure_string": "Zr4 Pb4\n1.0\n-0.172698 0.000000 6.937442\n3.511528 0.000000 -2.010626\n0.000000 8.769808 0.000000\nZr Pb\n4 4\ndirect\n0.270794 0.021956 0.127606 Zr\n0.729206 0.978044 0.872394 Zr\n0.229206 0.978044 0.627606 Zr\n0.770794 0.021956 0.372394 Zr\n0.268596 0.516304 0.378167 Pb\n0.731404 0.483696 0.621833 Pb\n0.231404 0.483696 0.878167 Pb\n0.768596 0.516304 0.121833 Pb\n",
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"formula_full": "Zr4 Pb4",
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{
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"structure_string": "Na2 Ca2 Mg12\n1.0\n5.387808 0.000000 0.000000\n0.000000 6.631141 0.000000\n0.000000 0.000000 11.789207\nNa Ca Mg\n2 2 12\ndirect\n0.500000 0.500000 0.166669 Na\n0.500000 0.000000 0.666669 Na\n0.500000 0.000000 0.167420 Ca\n0.500000 0.500000 0.667420 Ca\n0.500000 0.247151 0.418554 Mg\n0.500000 0.752849 0.418554 Mg\n0.000000 0.747970 0.078259 Mg\n0.000000 0.252030 0.078259 Mg\n0.000000 0.000000 0.336894 Mg\n0.000000 0.500000 0.335387 Mg\n0.500000 0.747151 0.918554 Mg\n0.500000 0.252849 0.918554 Mg\n0.000000 0.247970 0.578259 Mg\n0.000000 0.752030 0.578259 Mg\n0.000000 0.500000 0.836894 Mg\n0.000000 0.000000 0.835387 Mg\n",
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{
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{
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{
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"structure_string": "Yb2 In1 Ga1\n1.0\n0.000000 3.748110 3.748110\n3.748110 0.000000 3.748110\n3.748110 3.748110 0.000000\nYb In Ga\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Yb\n0.750000 0.750000 0.750000 Yb\n0.000000 0.000000 0.000000 In\n0.500000 0.500000 0.500000 Ga\n",
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]
}