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{
"id": "mp-27760",
"created_at": "2022-09-04T14:39:10.667332Z",
"structure_string": "Pr2 Si4\n1.0\n-2.114961 2.114961 7.081787\n2.114961 -2.114961 7.081787\n2.114961 2.114961 -7.081787\nPr Si\n2 4\ndirect\n0.750000 0.250000 0.500000 Pr\n0.000000 0.000000 0.000000 Pr\n0.166184 0.666184 0.500000 Si\n0.583816 0.583816 0.000000 Si\n0.333816 0.833816 0.500000 Si\n0.416184 0.416184 0.000000 Si\n",
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{
"id": "mp-2498",
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"structure_string": "Pr2 Os4\n1.0\n0.000000 3.868295 3.868295\n3.868295 0.000000 3.868295\n3.868295 3.868295 0.000000\nPr Os\n2 4\ndirect\n0.750000 0.750000 0.750000 Pr\n0.500000 0.500000 0.500000 Pr\n0.125000 0.625000 0.125000 Os\n0.125000 0.125000 0.625000 Os\n0.625000 0.125000 0.125000 Os\n0.125000 0.125000 0.125000 Os\n",
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"volume": 115.76805980420752,
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"formula_full": "Pr2 Os4",
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"energy": -54.64634698,
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"spacegroup": 227
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{
"id": "mp-976982",
"created_at": "2022-09-04T14:39:11.605964Z",
"structure_string": "Li4 Mg2\n1.0\n1.594923 -7.614148 0.000000\n1.594923 7.614148 0.000000\n0.000000 0.000000 5.009274\nLi Mg\n4 2\ndirect\n0.600757 0.399243 0.750000 Li\n0.263156 0.736844 0.750000 Li\n0.399243 0.600757 0.250000 Li\n0.736844 0.263156 0.250000 Li\n0.932082 0.067918 0.750000 Mg\n0.067918 0.932082 0.250000 Mg\n",
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"density": 1.0423865906742342,
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"volume": 121.66504424282515,
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"formula_full": "Li4 Mg2",
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"spacegroup": 63
},
{
"id": "mp-1024999",
"created_at": "2022-09-04T14:39:10.110697Z",
"structure_string": "Ho1 Cr2 Si2 C1\n1.0\n3.961089 0.000000 0.000000\n0.000000 3.961089 0.000000\n0.000000 0.000000 5.217658\nHo Cr Si C\n1 2 2 1\ndirect\n0.000000 0.000000 0.500000 Ho\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.000000 Cr\n0.500000 0.500000 0.270764 Si\n0.500000 0.500000 0.729236 Si\n0.000000 0.000000 0.000000 C\n",
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"volume": 81.86623355466124,
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"formula_full": "Ho1 Cr2 Si2 C1",
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"formula_anonymous": "ABC2D2",
"energy": -46.57178599,
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"updated_at": "2021-11-28T01:34:27.523000Z",
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{
"id": "mp-1224689",
"created_at": "2022-09-04T14:48:28.242865Z",
"structure_string": "Gd1 Er1 Co4\n1.0\n0.000000 3.563962 3.563962\n3.563962 0.000000 3.563962\n3.563962 3.563962 0.000000\nGd Er Co\n1 1 4\ndirect\n0.500000 0.500000 0.500000 Gd\n0.250000 0.250000 0.250000 Er\n0.874971 0.375086 0.874971 Co\n0.874971 0.874971 0.874971 Co\n0.874971 0.874971 0.375086 Co\n0.375086 0.874971 0.874971 Co\n",
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"Er",
"Co"
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"density_atomic": 0.06627077665097382,
"volume": 90.53764424099039,
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"formula_full": "Gd1 Er1 Co4",
"formula_reduced": "GdErCo4",
"formula_anonymous": "ABC4",
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"updated_at": "2021-11-28T01:39:16.309000Z",
"spacegroup": 216
},
{
"id": "mp-1224972",
"created_at": "2022-09-04T14:39:07.431725Z",
"structure_string": "Fe1 Co1 As4\n1.0\n2.969687 0.000000 0.000000\n0.000000 5.220714 0.000000\n0.000000 0.006590 5.942026\nFe Co As\n1 1 4\ndirect\n0.000000 0.000000 0.000000 Fe\n0.500000 0.500000 0.500000 Co\n0.500000 0.317138 0.137299 As\n0.500000 0.682862 0.862701 As\n0.000000 0.818011 0.360907 As\n0.000000 0.181989 0.639093 As\n",
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"density": 7.470701894144317,
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"volume": 92.12449666335887,
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"formula_full": "Fe1 Co1 As4",
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"formula_anonymous": "ABC4",
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"spacegroup": 10
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{
"id": "mp-1094456",
"created_at": "2022-09-04T14:39:09.059931Z",
"structure_string": "Mg2 Zn4\n1.0\n1.472128 5.407796 0.000000\n-1.472128 5.407796 0.000000\n0.000000 2.041790 6.470570\nMg Zn\n2 4\ndirect\n0.811911 0.811911 0.645465 Mg\n0.188089 0.188089 0.354535 Mg\n0.132962 0.132962 0.978203 Zn\n0.530729 0.530729 0.704536 Zn\n0.469271 0.469271 0.295464 Zn\n0.867038 0.867038 0.021797 Zn\n",
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"volume": 103.024000257368,
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"formula_full": "Mg2 Zn4",
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{
"id": "mp-1023941",
"created_at": "2022-09-04T14:39:12.693757Z",
"structure_string": "Te4 Mo1 W1\n1.0\n1.776161 -3.076401 0.000000\n1.776161 3.076401 0.000000\n0.000000 0.000000 25.048577\nTe Mo W\n4 1 1\ndirect\n0.333333 0.666667 0.523852 Te\n0.666667 0.333333 0.077938 Te\n0.666667 0.333333 0.223011 Te\n0.333333 0.666667 0.378945 Te\n0.666667 0.333333 0.451412 Mo\n0.333333 0.666667 0.150446 W\n",
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{
"id": "mp-1094593",
"created_at": "2022-09-04T14:39:14.850590Z",
"structure_string": "Li2 Mg4\n1.0\n2.752767 -4.604668 0.000000\n2.752767 4.604668 0.000000\n0.000000 0.000000 5.114629\nLi Mg\n2 4\ndirect\n0.665495 0.665495 0.750000 Li\n0.334505 0.334505 0.250000 Li\n0.002020 0.333307 0.750000 Mg\n0.333307 0.002020 0.750000 Mg\n0.666693 0.997980 0.250000 Mg\n0.997980 0.666693 0.250000 Mg\n",
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{
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"structure_string": "Mo2 As1 P3\n1.0\n1.590725 5.715076 0.000000\n-1.590725 5.715076 0.000000\n0.000000 0.073713 5.095973\nMo As P\n2 1 3\ndirect\n0.091378 0.091378 0.497795 Mo\n0.909553 0.909553 0.007621 Mo\n0.295921 0.295921 0.700402 As\n0.699908 0.699908 0.196768 P\n0.434283 0.434283 0.373393 P\n0.568956 0.568956 0.882020 P\n",
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{
"id": "mp-1018682",
"created_at": "2022-09-04T14:48:31.630084Z",
"structure_string": "Dy2 Zn2 Ga2\n1.0\n2.208795 -3.825745 0.000000\n2.208795 3.825745 0.000000\n0.000000 0.000000 7.174843\nDy Zn Ga\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Dy\n0.000000 0.000000 0.000000 Dy\n0.333333 0.666667 0.750000 Zn\n0.666667 0.333333 0.250000 Zn\n0.333333 0.666667 0.250000 Ga\n0.666667 0.333333 0.750000 Ga\n",
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"formula_full": "Dy2 Zn2 Ga2",
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"formula_anonymous": "ABC",
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]
}