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{
"id": "mp-1038767",
"created_at": "2022-09-04T14:41:09.262719Z",
"structure_string": "Mg2 Cd2\n1.0\n1.607753 5.718886 0.000000\n-1.607753 5.718886 0.000000\n0.000000 2.306885 4.780155\nMg Cd\n2 2\ndirect\n0.875998 0.875998 0.793041 Mg\n0.124002 0.124002 0.206959 Mg\n0.624445 0.624445 0.711432 Cd\n0.375555 0.375555 0.288568 Cd\n",
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{
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{
"id": "mp-8094",
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"structure_string": "Ba2 Hg1\n1.0\n-2.133911 2.133911 7.631326\n2.133911 -2.133911 7.631326\n2.133911 2.133911 -7.631326\nBa Hg\n2 1\ndirect\n0.369497 0.369497 0.000000 Ba\n0.630503 0.630503 0.000000 Ba\n0.000000 0.000000 0.000000 Hg\n",
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"formula_full": "Ba2 Hg1",
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"updated_at": "2021-11-28T01:35:21.194000Z",
"spacegroup": 139
},
{
"id": "mp-974828",
"created_at": "2022-09-04T14:39:46.181506Z",
"structure_string": "Rb3 Pr1\n1.0\n0.000000 5.160494 5.160494\n5.160494 0.000000 5.160494\n5.160494 5.160494 0.000000\nRb Pr\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Pr\n",
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"elements": [
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"density": 2.400357414902987,
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"volume": 274.8551178339957,
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"formula_full": "Rb3 Pr1",
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"updated_at": "2021-11-28T01:34:44.963000Z",
"spacegroup": 225
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{
"id": "mp-974982",
"created_at": "2022-09-04T14:44:25.312429Z",
"structure_string": "Rb3 In1\n1.0\n-3.159588 3.159588 5.878530\n3.159588 -3.159588 5.878530\n3.159588 3.159588 -5.878530\nRb In\n3 1\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 In\n",
"nsites": 4,
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"updated_at": "2021-11-28T01:36:38.986000Z",
"spacegroup": 139
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{
"id": "mp-2459",
"created_at": "2022-09-04T14:44:56.827791Z",
"structure_string": "Yb1 In1\n1.0\n3.830621 0.000000 0.000000\n0.000000 3.830621 0.000000\n0.000000 0.000000 3.830621\nYb In\n1 1\ndirect\n0.500000 0.500000 0.500000 Yb\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
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"density": 8.503933306730353,
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"volume": 56.20921959195457,
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"updated_at": "2021-11-28T01:36:46.382000Z",
"spacegroup": 221
},
{
"id": "mp-22885",
"created_at": "2022-09-04T14:40:32.608831Z",
"structure_string": "Xe1 F2\n1.0\n-2.241840 2.241840 3.612412\n2.241840 -2.241840 3.612412\n2.241840 2.241840 -3.612412\nXe F\n1 2\ndirect\n0.000000 0.000000 0.000000 Xe\n0.712301 0.712301 0.000000 F\n0.287699 0.287699 0.000000 F\n",
"nsites": 3,
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"elements": [
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"density": 3.8709130007164902,
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"volume": 72.62171406392186,
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"formula_full": "Xe1 F2",
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"formula_anonymous": "AB2",
"energy": -6.20931119,
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"updated_at": "2021-11-28T01:35:00.007000Z",
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},
{
"id": "mp-1039164",
"created_at": "2022-09-04T14:46:39.165987Z",
"structure_string": "Mg2 Cd2\n1.0\n3.184373 0.000000 0.000000\n0.000000 5.242427 0.000000\n0.000000 0.000000 5.303635\nMg Cd\n2 2\ndirect\n0.000000 0.000000 0.086029 Mg\n0.500000 0.500000 0.913971 Mg\n0.500000 0.000000 0.594491 Cd\n0.000000 0.500000 0.405509 Cd\n",
"nsites": 4,
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],
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"density": 5.1282416784940255,
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"volume": 88.53804998361684,
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"formula_full": "Mg2 Cd2",
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{
"id": "mp-975052",
"created_at": "2022-09-04T14:43:34.608349Z",
"structure_string": "Rb3 Al1\n1.0\n0.000000 4.775173 4.775173\n4.775173 0.000000 4.775173\n4.775173 4.775173 0.000000\nRb Al\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Al\n",
"nsites": 4,
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"elements": [
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"formula_full": "Rb3 Al1",
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{
"id": "mp-1096130",
"created_at": "2022-09-04T14:47:04.284202Z",
"structure_string": "Na1 Tl2 In1\n1.0\n-5.991034 6.564466 9.254610\n5.991034 -6.564466 9.254610\n5.991034 6.564466 -9.254610\nNa Tl In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.260995 0.260995 Tl\n0.000000 0.739005 0.739005 Tl\n0.000000 0.500000 0.500000 In\n",
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"formula_full": "Na1 Tl2 In1",
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{
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"structure_string": "P1\n1.0\n2.447489 0.000000 0.000000\n0.000000 2.447489 0.000000\n0.000000 0.000000 2.447489\nP\n1\ndirect\n0.500000 0.500000 0.500000 P\n",
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{
"id": "mp-1186848",
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"structure_string": "Rb3 In1\n1.0\n0.000000 4.854502 4.854502\n4.854502 0.000000 4.854502\n4.854502 4.854502 0.000000\nRb In\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 In\n",
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]
}