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"results": [
{
"id": "jvasp-12277",
"created_at": "2022-09-04T14:37:04.612964Z",
"updated_at": "2022-09-04T14:37:04.612989Z",
"structure_string": "U2 Mn2 Se6\n1.0\n3.907667 0.000000 0.000000\n-1.953834 5.541062 -0.000000\n0.000000 -0.000000 9.158653\nU Mn Se\n2 2 6\ndirect\n0.222101 0.444200 0.250000 U\n0.777901 0.555799 0.750000 U\n0.000000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.078003 0.156005 0.750000 Se\n0.921999 0.843995 0.250000 Se\n0.364303 0.728606 0.960390 Se\n0.635698 0.271394 0.039610 Se\n0.635698 0.271394 0.460390 Se\n0.364303 0.728606 0.539610 Se\n",
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{
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"structure_string": "U6 Mn2 Sb10\n1.0\n4.501685 -7.797147 0.000000\n4.501685 7.797147 0.000000\n0.000000 -0.000000 6.123263\nU Mn Sb\n6 2 10\ndirect\n-0.000000 0.610018 0.250000 U\n0.610018 0.610018 0.750000 U\n0.389982 -0.000000 0.750000 U\n0.610018 -0.000000 0.250000 U\n0.389981 0.389981 0.250000 U\n-0.000000 0.389982 0.750000 U\n0.000000 0.000000 0.000000 Mn\n0.000000 0.000000 0.500000 Mn\n0.752968 0.752968 0.250000 Sb\n-0.000001 0.752969 0.750000 Sb\n0.666667 0.333332 0.000000 Sb\n0.333332 0.666667 0.500000 Sb\n0.666667 0.333332 0.500000 Sb\n-0.000000 0.247031 0.250000 Sb\n0.333332 0.666667 0.000000 Sb\n0.247031 -0.000000 0.250000 Sb\n0.247031 0.247031 0.750000 Sb\n0.752969 -0.000001 0.750000 Sb\n",
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"formula_full": "U6 Mn2 Sb10",
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"spacegroup": 193
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{
"id": "jvasp-56612",
"created_at": "2022-09-04T14:38:29.663530Z",
"updated_at": "2022-09-04T14:38:29.663539Z",
"structure_string": "U2 Mn1 N3\n1.0\n3.197962 -0.000077 -0.833432\n-0.275710 3.587853 -1.057757\n0.002853 -0.024577 6.563796\nU Mn N\n2 1 3\ndirect\n0.356180 0.356162 0.712359 U\n0.643818 0.643835 0.287640 U\n0.000000 0.000000 0.000000 Mn\n0.168077 0.168075 0.336154 N\n0.831921 0.831923 0.663845 N\n-0.000000 0.500000 -0.000000 N\n",
"nsites": 6,
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"density_atomic": 0.07975392558624075,
"volume": 75.23140655329858,
"volume_molar": 7.550901997279174,
"formula_full": "U2 Mn1 N3",
"formula_reduced": "U2MnN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 5.627144831896552,
"spacegroup": 71
},
{
"id": "jvasp-17676",
"created_at": "2022-09-04T14:38:14.250683Z",
"updated_at": "2022-09-04T14:38:14.250701Z",
"structure_string": "U1 Mn2 Ge2\n1.0\n3.843733 -0.000000 -1.335707\n-0.464161 3.815604 -1.335707\n-0.213309 -0.240830 5.584529\nU Mn Ge\n1 2 2\ndirect\n0.000000 0.000000 0.000000 U\n0.250000 0.749999 0.499999 Mn\n0.749999 0.250000 0.499999 Mn\n0.628951 0.628950 0.257901 Ge\n0.371049 0.371048 0.742097 Ge\n",
"nsites": 5,
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"elements": [
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"Mn",
"Ge"
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"chemical_system": "Ge-Mn-U",
"density": 10.310279809391753,
"density_atomic": 0.06294793668562515,
"volume": 79.4307210571654,
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"formula_full": "U1 Mn2 Ge2",
"formula_reduced": "U(MnGe)2",
"formula_anonymous": "AB2C2",
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"spacegroup": 139
},
{
"id": "jvasp-63266",
"created_at": "2022-09-04T14:35:59.084898Z",
"updated_at": "2022-09-04T14:35:59.084925Z",
"structure_string": "U4 Mn4 B16\n1.0\n3.456921 0.000000 0.000000\n0.000000 5.841372 -0.000000\n0.000000 -0.000000 11.322587\nU Mn B\n4 4 16\ndirect\n0.000000 0.126609 0.849537 U\n0.000000 0.873391 0.150463 U\n0.000000 0.373391 0.349537 U\n0.000000 0.626608 0.650463 U\n0.000000 0.135601 0.591256 Mn\n0.000000 0.864399 0.408745 Mn\n0.000000 0.364399 0.091255 Mn\n0.000000 0.635601 0.908745 Mn\n0.500000 0.526271 0.191242 B\n0.500000 0.473729 0.808758 B\n0.500000 0.886832 0.545793 B\n0.500000 0.113168 0.454207 B\n0.500000 0.613168 0.045793 B\n0.500000 0.386832 0.954207 B\n0.500000 0.864263 0.966785 B\n0.500000 0.784122 0.813058 B\n0.500000 0.635737 0.466785 B\n0.500000 0.364263 0.533215 B\n0.500000 0.026271 0.308758 B\n0.500000 0.215878 0.186942 B\n0.500000 0.715878 0.313058 B\n0.500000 0.284122 0.686942 B\n0.500000 0.135737 0.033215 B\n0.500000 0.973729 0.691242 B\n",
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"elements": [
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"chemical_system": "B-Mn-U",
"density": 9.767219847423947,
"density_atomic": 0.10496904738046894,
"volume": 228.63882829202046,
"volume_molar": 5.737063363233408,
"formula_full": "U4 Mn4 B16",
"formula_reduced": "UMnB4",
"formula_anonymous": "ABC4",
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"spacegroup": 55
},
{
"id": "jvasp-119436",
"created_at": "2022-09-04T14:38:49.711765Z",
"updated_at": "2022-09-04T14:38:49.711785Z",
"structure_string": "U4 Mn4 B16\n1.0\n3.462695 -0.000000 0.000000\n0.000000 5.840725 0.000000\n0.000000 -0.000000 11.320843\nU Mn B\n4 4 16\ndirect\n-0.000000 0.626542 0.349509 U\n-0.000000 0.373459 0.650491 U\n-0.000000 0.126541 0.150491 U\n-0.000000 0.873459 0.849509 U\n-0.000000 0.635602 0.091283 Mn\n-0.000000 0.364398 0.908717 Mn\n-0.000000 0.135602 0.408717 Mn\n-0.000000 0.864399 0.591283 Mn\n0.500001 0.026112 0.691129 B\n0.500001 0.973889 0.308870 B\n0.500001 0.613108 0.954192 B\n0.500001 0.386893 0.045808 B\n0.500001 0.113108 0.545808 B\n0.500001 0.886893 0.454192 B\n0.500001 0.636010 0.533186 B\n0.500001 0.716041 0.686751 B\n0.500001 0.136010 0.966813 B\n0.500001 0.863991 0.033186 B\n0.500001 0.473889 0.191129 B\n0.500001 0.283959 0.313248 B\n0.500001 0.216041 0.813248 B\n0.500001 0.783960 0.186751 B\n0.500001 0.363991 0.466814 B\n0.500001 0.526112 0.808870 B\n",
"nsites": 24,
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"elements": [
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"chemical_system": "B-Mn-U",
"density": 9.75351559970963,
"density_atomic": 0.10482176679806071,
"volume": 228.96007893318603,
"volume_molar": 5.745124265651487,
"formula_full": "U4 Mn4 B16",
"formula_reduced": "UMnB4",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.100722262452107,
"spacegroup": 55
},
{
"id": "jvasp-100328",
"created_at": "2022-09-04T14:36:34.576662Z",
"updated_at": "2022-09-04T14:36:34.576680Z",
"structure_string": "U2 Mn2 Al2\n1.0\n4.591135 -0.214287 -2.072673\n-1.769329 4.087637 -2.362438\n0.067751 0.214287 5.036854\nU Mn Al\n2 2 2\ndirect\n0.430247 0.180246 0.250000 U\n0.569754 0.819755 0.750000 U\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500001 0.500000 Mn\n0.000000 0.500000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n",
"nsites": 6,
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"elements": [
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"chemical_system": "Al-Mn-U",
"density": 11.030014645702952,
"density_atomic": 0.062282806888864374,
"volume": 96.33477198139488,
"volume_molar": 9.66902594924107,
"formula_full": "U2 Mn2 Al2",
"formula_reduced": "UMnAl",
"formula_anonymous": "ABC",
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"spacegroup": 74
},
{
"id": "jvasp-59678",
"created_at": "2022-09-04T14:38:35.369073Z",
"updated_at": "2022-09-04T14:38:35.369087Z",
"structure_string": "U1 Mn4 Al8\n1.0\n4.584266 -0.000000 1.867458\n2.292133 6.186052 0.933730\n-0.041626 -0.000000 6.662675\nU Mn Al\n1 4 8\ndirect\n0.000000 0.000000 0.000000 U\n0.500000 0.000000 0.500000 Mn\n-0.000000 0.500000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n-0.000000 0.000000 0.500000 Mn\n0.342725 0.657275 0.657275 Al\n-0.000001 0.342725 0.657275 Al\n-0.000001 0.657275 0.342725 Al\n0.657275 0.342725 0.342725 Al\n0.282630 0.217370 0.217370 Al\n0.500000 0.782630 0.217370 Al\n0.500000 0.217370 0.782630 Al\n0.717370 0.782630 0.782630 Al\n",
"nsites": 13,
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"density": 5.90522982895434,
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"volume": 189.42439289818648,
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"formula_full": "U1 Mn4 Al8",
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{
"id": "jvasp-101093",
"created_at": "2022-09-04T14:36:47.550166Z",
"updated_at": "2022-09-04T14:36:47.550183Z",
"structure_string": "U2 Mn1 Al3\n1.0\n4.490964 0.001997 3.134470\n1.635788 4.182458 3.134470\n0.002925 0.001997 5.476646\nU Mn Al\n2 1 3\ndirect\n0.142244 0.142244 0.142244 U\n0.857754 0.857757 0.857757 U\n0.499999 0.500001 0.500000 Mn\n0.499999 0.000001 0.500001 Al\n-0.000001 0.500001 0.500000 Al\n0.500000 0.500001 -0.000000 Al\n",
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"formula_full": "U2 Mn1 Al3",
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},
{
"id": "jvasp-93774",
"created_at": "2022-09-04T14:35:57.235984Z",
"updated_at": "2022-09-04T14:35:57.236003Z",
"structure_string": "U1 Ir1 Pt4\n1.0\n-3.729959 -3.729959 0.000000\n-3.729959 -0.000000 -3.729959\n0.000000 -3.729959 -3.729959\nU Ir Pt\n1 1 4\ndirect\n0.000000 0.000000 0.000000 U\n0.750000 0.750000 0.750000 Ir\n0.873995 0.375335 0.375335 Pt\n0.375335 0.873995 0.375335 Pt\n0.375335 0.375335 0.873995 Pt\n0.375335 0.375335 0.375335 Pt\n",
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{
"id": "jvasp-92614",
"created_at": "2022-09-04T14:35:50.032171Z",
"updated_at": "2022-09-04T14:35:50.032195Z",
"structure_string": "U2 Ir1 C2\n1.0\n3.488909 -0.000000 0.000000\n-0.000000 3.488909 0.000000\n-1.744455 -1.744455 6.246704\nU Ir C\n2 1 2\ndirect\n0.645922 0.645922 0.291843 U\n0.354077 0.354077 0.708156 U\n0.000000 0.000000 0.000000 Ir\n0.829448 0.829448 0.658896 C\n0.170551 0.170551 0.341103 C\n",
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{
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"created_at": "2022-09-04T14:35:45.704879Z",
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"structure_string": "U2 Ir1 C2\n1.0\n3.369438 -0.000000 -0.904983\n-0.243066 3.360659 -0.904983\n-0.002330 -0.002504 6.716370\nU Ir C\n2 1 2\ndirect\n0.354073 0.354074 0.708147 U\n0.645927 0.645927 0.291855 U\n0.000000 0.000000 0.000000 Ir\n0.829451 0.829453 0.658905 C\n0.170548 0.170549 0.341096 C\n",
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}
]
}