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{
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"next": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_per_atom&page=3",
"previous": "https://simmate.org/third-parties/MatprojStructure/?format=api&ordering=energy_per_atom",
"results": [
{
"id": "mp-1186856",
"created_at": "2022-09-04T14:39:58.844191Z",
"structure_string": "Pu3 Np1\n1.0\n-2.260818 2.260818 4.471573\n2.260818 -2.260818 4.471573\n2.260818 2.260818 -4.471573\nPu Np\n3 1\ndirect\n0.750000 0.250000 0.500000 Pu\n0.250000 0.750000 0.500000 Pu\n0.500000 0.500000 0.000000 Pu\n0.000000 0.000000 0.000000 Np\n",
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{
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"structure_string": "Pu1\n1.0\n-1.603259 1.603259 1.603259\n1.603259 -1.603259 1.603259\n1.603259 1.603259 -1.603259\nPu\n1\ndirect\n0.000000 0.000000 0.000000 Pu\n",
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},
{
"id": "mp-542606",
"created_at": "2022-09-04T14:39:41.157603Z",
"structure_string": "Pu17\n1.0\n5.168143 5.826663 0.000000\n-5.168143 5.826663 0.000000\n0.000000 4.625207 6.288572\nPu\n17\ndirect\n0.000000 0.000000 0.000000 Pu\n0.731364 0.268636 0.500000 Pu\n0.268636 0.731364 0.500000 Pu\n0.868015 0.868015 0.758336 Pu\n0.131985 0.131985 0.241664 Pu\n0.682516 0.682516 0.242862 Pu\n0.317484 0.317484 0.757138 Pu\n0.593645 0.593645 0.729164 Pu\n0.406355 0.406355 0.270836 Pu\n0.145150 0.575429 0.025474 Pu\n0.424571 0.854850 0.974526 Pu\n0.854850 0.424571 0.974526 Pu\n0.575429 0.145150 0.025474 Pu\n0.990939 0.690284 0.416690 Pu\n0.309716 0.009061 0.583310 Pu\n0.009061 0.309716 0.583310 Pu\n0.690284 0.990939 0.416690 Pu\n",
"nsites": 17,
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"elements": [
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"volume": 378.73588436104075,
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"formula_full": "Pu17",
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"energy": -229.10815608,
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"updated_at": "2021-11-28T01:34:23.685000Z",
"spacegroup": 12
},
{
"id": "mp-1186826",
"created_at": "2022-09-04T14:48:12.229061Z",
"structure_string": "Pu3 Ta1\n1.0\n-2.262418 2.262418 4.345358\n2.262418 -2.262418 4.345358\n2.262418 2.262418 -4.345358\nPu Ta\n3 1\ndirect\n0.750000 0.250000 0.500000 Pu\n0.250000 0.750000 0.500000 Pu\n0.500000 0.500000 0.000000 Pu\n0.000000 0.000000 0.000000 Ta\n",
"nsites": 4,
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"elements": [
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"density": 17.0397741179429,
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"volume": 88.96747163527914,
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"formula_full": "Pu3 Ta1",
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"updated_at": "2021-11-28T01:38:27.824000Z",
"spacegroup": 139
},
{
"id": "mp-1105464",
"created_at": "2022-09-04T14:46:04.142170Z",
"structure_string": "Pu12 Fe2\n1.0\n0.000000 0.000000 -5.686250\n-5.091482 -5.091482 -2.843125\n-5.091482 5.091482 -2.843125\nPu Fe\n12 2\ndirect\n0.901677 0.696647 0.500000 Pu\n0.098323 0.303353 0.500000 Pu\n0.598323 0.500000 0.303353 Pu\n0.401677 0.500000 0.696647 Pu\n0.090412 0.689071 0.130105 Pu\n0.909588 0.310929 0.869895 Pu\n0.409588 0.869895 0.310929 Pu\n0.590412 0.130105 0.689071 Pu\n0.220517 0.869895 0.689071 Pu\n0.779483 0.130105 0.310929 Pu\n0.720517 0.689071 0.869895 Pu\n0.279483 0.310929 0.130105 Pu\n0.250000 0.000000 0.000000 Fe\n0.750000 0.000000 0.000000 Fe\n",
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"elements": [
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"chemical_system": "Fe-Pu",
"density": 17.12119293353965,
"density_atomic": 0.04748797653863853,
"volume": 294.8114664057947,
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"formula_full": "Pu12 Fe2",
"formula_reduced": "Pu6Fe",
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"energy": -186.97109317,
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"updated_at": "2021-11-28T01:37:21.390000Z",
"spacegroup": 140
},
{
"id": "mp-30823",
"created_at": "2022-09-04T14:45:36.659768Z",
"structure_string": "Pu10 Os6\n1.0\n-5.481940 5.481940 2.770745\n5.481940 -5.481940 2.770745\n5.481940 5.481940 -2.770745\nPu Os\n10 6\ndirect\n0.750000 0.250000 0.500000 Pu\n0.250000 0.750000 0.500000 Pu\n0.219436 0.912966 0.132402 Pu\n0.087034 0.219436 0.306469 Pu\n0.912966 0.780564 0.693531 Pu\n0.780564 0.087034 0.867598 Pu\n0.412966 0.719436 0.132402 Pu\n0.587034 0.280564 0.867598 Pu\n0.719436 0.587034 0.306469 Pu\n0.280564 0.412966 0.693531 Pu\n0.250000 0.250000 0.000000 Os\n0.750000 0.750000 0.000000 Os\n0.650464 0.849536 0.500000 Os\n0.150464 0.650464 0.800929 Os\n0.849536 0.349536 0.199071 Os\n0.349536 0.150464 0.500000 Os\n",
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"elements": [
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],
"chemical_system": "Os-Pu",
"density": 17.855597857074347,
"density_atomic": 0.04803910165865259,
"volume": 333.0620150578555,
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"formula_full": "Pu10 Os6",
"formula_reduced": "Pu5Os3",
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"energy": -208.6423373,
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{
"id": "mp-940",
"created_at": "2022-09-04T14:42:50.463232Z",
"structure_string": "Gd1 N1\n1.0\n0.000000 2.494121 2.494121\n2.494121 0.000000 2.494121\n2.494121 2.494121 0.000000\nGd N\n1 1\ndirect\n0.000000 0.000000 0.000000 Gd\n0.500000 0.500000 0.500000 N\n",
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"density": 9.164612691797455,
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"volume": 31.030055533227458,
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"formula_full": "Gd1 N1",
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"energy": -25.93033487,
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"updated_at": "2021-11-28T01:35:49.527000Z",
"spacegroup": 225
},
{
"id": "mp-91",
"created_at": "2022-09-04T14:43:55.560345Z",
"structure_string": "W1\n1.0\n-1.593707 1.593707 1.593707\n1.593707 -1.593707 1.593707\n1.593707 1.593707 -1.593707\nW\n1\ndirect\n0.000000 0.000000 0.000000 W\n",
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"formula_full": "W1",
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"updated_at": "2021-11-28T01:36:25.617000Z",
"spacegroup": 229
},
{
"id": "mp-11534",
"created_at": "2022-09-04T14:47:05.234801Z",
"structure_string": "Np8\n1.0\n4.666573 0.000000 0.000000\n0.000000 4.796107 0.000000\n0.000000 0.000000 6.586571\nNp\n8\ndirect\n0.250000 0.217798 0.044816 Np\n0.750000 0.782202 0.955184 Np\n0.750000 0.717798 0.455184 Np\n0.250000 0.282202 0.544816 Np\n0.250000 0.860069 0.318009 Np\n0.750000 0.139931 0.681991 Np\n0.750000 0.360069 0.181991 Np\n0.250000 0.639931 0.818009 Np\n",
"nsites": 8,
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"volume": 147.41657104855352,
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"formula_full": "Np8",
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"energy": -103.58223745,
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},
{
"id": "mp-1186843",
"created_at": "2022-09-04T14:41:27.115062Z",
"structure_string": "Pu3 Ru1\n1.0\n-2.012851 2.012851 5.100236\n2.012851 -2.012851 5.100236\n2.012851 2.012851 -5.100236\nPu Ru\n3 1\ndirect\n0.750002 0.250000 0.500002 Pu\n0.250000 0.750002 0.500002 Pu\n0.499999 0.499999 0.000000 Pu\n0.000000 0.000000 0.000000 Ru\n",
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"spacegroup": 139
},
{
"id": "mp-1209844",
"created_at": "2022-09-04T14:42:02.565924Z",
"structure_string": "Pu8 Ir2\n1.0\n-5.254630 -5.254630 0.000000\n-5.254630 0.000000 -5.254630\n0.000000 -5.254630 -5.254630\nPu Ir\n8 2\ndirect\n0.607161 0.607161 0.607161 Pu\n0.178518 0.607161 0.607161 Pu\n0.607161 0.178518 0.607161 Pu\n0.571482 0.142839 0.142839 Pu\n0.142839 0.142839 0.142839 Pu\n0.607161 0.607161 0.178518 Pu\n0.142839 0.571482 0.142839 Pu\n0.142839 0.142839 0.571482 Pu\n0.000000 0.000000 0.000000 Ir\n0.750000 0.750000 0.750000 Ir\n",
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"formula_full": "Pu8 Ir2",
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"energy": -128.79098109,
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"spacegroup": 227
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{
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"formula_full": "W8",
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"updated_at": "2021-11-28T01:35:28.097000Z",
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}
]
}