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{
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{
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{
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"created_at": "2022-09-04T14:45:24.039125Z",
"structure_string": "Dy4 Ga12 Pt1\n1.0\n-4.318696 4.318696 4.318696\n4.318696 -4.318696 4.318696\n4.318696 4.318696 -4.318696\nDy Ga Pt\n4 12 1\ndirect\n0.500000 0.500000 0.500000 Dy\n0.000000 0.000000 0.500000 Dy\n0.000000 0.500000 0.000000 Dy\n0.500000 0.000000 0.000000 Dy\n0.000000 0.296925 0.296925 Ga\n0.000000 0.703075 0.703075 Ga\n0.296925 0.000000 0.296925 Ga\n0.703075 0.000000 0.703075 Ga\n0.296925 0.296925 0.000000 Ga\n0.703075 0.703075 0.000000 Ga\n0.500000 0.750000 0.250000 Ga\n0.500000 0.250000 0.750000 Ga\n0.250000 0.500000 0.750000 Ga\n0.750000 0.500000 0.250000 Ga\n0.750000 0.250000 0.500000 Ga\n0.250000 0.750000 0.500000 Ga\n0.000000 0.000000 0.000000 Pt\n",
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{
"id": "mp-2473",
"created_at": "2022-09-04T14:45:24.545160Z",
"structure_string": "Re6 As14\n1.0\n-4.432201 4.432201 4.432201\n4.432201 -4.432201 4.432201\n4.432201 4.432201 -4.432201\nRe As\n6 14\ndirect\n0.340365 0.000000 0.340365 Re\n0.000000 0.340365 0.340365 Re\n0.000000 0.659635 0.659635 Re\n0.340365 0.340365 0.000000 Re\n0.659635 0.659635 0.000000 Re\n0.659635 0.000000 0.659635 Re\n0.750000 0.500000 0.250000 As\n0.500000 0.750000 0.250000 As\n0.500000 0.250000 0.750000 As\n0.750000 0.250000 0.500000 As\n0.250000 0.750000 0.500000 As\n0.250000 0.500000 0.750000 As\n0.000000 0.000000 0.331838 As\n0.668162 0.000000 0.000000 As\n0.000000 0.668162 0.000000 As\n0.331838 0.331838 0.331838 As\n0.000000 0.331838 0.000000 As\n0.668162 0.668162 0.668162 As\n0.331838 0.000000 0.000000 As\n0.000000 0.000000 0.668162 As\n",
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"formula_full": "Re6 As14",
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{
"id": "mp-1188792",
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"structure_string": "Ti4 Co7 Ge6\n1.0\n-3.829935 -3.829935 3.829935\n-3.829935 3.829935 -3.829935\n3.829935 -3.829935 -3.829935\nTi Co Ge\n4 7 6\ndirect\n0.000000 0.000000 0.500000 Ti\n0.500000 0.000000 0.000000 Ti\n0.000000 0.500000 0.000000 Ti\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Co\n0.250000 0.500000 0.750000 Co\n0.750000 0.500000 0.250000 Co\n0.500000 0.750000 0.250000 Co\n0.500000 0.250000 0.750000 Co\n0.750000 0.250000 0.500000 Co\n0.250000 0.750000 0.500000 Co\n0.687350 0.000000 0.687350 Ge\n0.312650 0.000000 0.312650 Ge\n0.000000 0.687350 0.687350 Ge\n0.000000 0.312650 0.312650 Ge\n0.687350 0.687350 0.000000 Ge\n0.312650 0.312650 0.000000 Ge\n",
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"density": 7.683897591370685,
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"formula_full": "Ti4 Co7 Ge6",
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{
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{
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"created_at": "2022-09-04T14:45:27.878045Z",
"structure_string": "Sm6 Al4 Ni12\n1.0\n-4.505189 4.505189 4.505189\n4.505189 -4.505189 4.505189\n4.505189 4.505189 -4.505189\nSm Al Ni\n6 4 12\ndirect\n0.292073 0.000000 0.292073 Sm\n0.000000 0.292073 0.292073 Sm\n0.000000 0.707927 0.707927 Sm\n0.707927 0.000000 0.707927 Sm\n0.292073 0.292073 0.000000 Sm\n0.707927 0.707927 0.000000 Sm\n0.500000 0.000000 0.000000 Al\n0.000000 0.500000 0.000000 Al\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.500000 Al\n0.666065 0.332130 0.666065 Ni\n0.666065 0.333935 0.000000 Ni\n0.333935 0.666065 0.000000 Ni\n0.332130 0.666065 0.666065 Ni\n0.666065 0.666065 0.332130 Ni\n0.333935 0.667870 0.333935 Ni\n0.333935 0.333935 0.667870 Ni\n0.667870 0.333935 0.333935 Ni\n0.000000 0.666065 0.333935 Ni\n0.666065 0.000000 0.333935 Ni\n0.333935 0.000000 0.666065 Ni\n0.000000 0.333935 0.666065 Ni\n",
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{
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{
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{
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"structure_string": "Sc4 Ge6 Os7\n1.0\n-4.090588 4.090588 4.090588\n4.090588 -4.090588 4.090588\n4.090588 4.090588 -4.090588\nSc Ge Os\n4 6 7\ndirect\n0.000000 0.000000 0.500000 Sc\n0.000000 0.500000 0.000000 Sc\n0.500000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.694314 0.694314 0.000000 Ge\n0.305686 0.000000 0.305686 Ge\n0.000000 0.305686 0.305686 Ge\n0.305686 0.305686 0.000000 Ge\n0.694314 0.000000 0.694314 Ge\n0.000000 0.694314 0.694314 Ge\n0.750000 0.250000 0.500000 Os\n0.750000 0.500000 0.250000 Os\n0.500000 0.250000 0.750000 Os\n0.250000 0.500000 0.750000 Os\n0.250000 0.750000 0.500000 Os\n0.500000 0.750000 0.250000 Os\n0.000000 0.000000 0.000000 Os\n",
"nsites": 17,
"nelements": 3,
"elements": [
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],
"chemical_system": "Ge-Os-Sc",
"density": 11.810244071089617,
"density_atomic": 0.062091436874454474,
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"formula_full": "Sc4 Ge6 Os7",
"formula_reduced": "Sc4Ge6Os7",
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"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -139.08798052,
"band_gap": 0.0,
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"total_magnetization": 0.0006232,
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"updated_at": "2021-11-28T01:37:06.269000Z",
"spacegroup": 229
},
{
"id": "mp-22344",
"created_at": "2022-09-04T14:45:35.784613Z",
"structure_string": "Sn14 Ru6\n1.0\n-4.739145 4.739145 4.739145\n4.739145 -4.739145 4.739145\n4.739145 4.739145 -4.739145\nSn Ru\n14 6\ndirect\n0.250000 0.750000 0.500000 Sn\n0.750000 0.250000 0.500000 Sn\n0.750000 0.500000 0.250000 Sn\n0.250000 0.500000 0.750000 Sn\n0.500000 0.750000 0.250000 Sn\n0.500000 0.250000 0.750000 Sn\n0.000000 0.000000 0.322198 Sn\n0.677802 0.000000 0.000000 Sn\n0.000000 0.677802 0.000000 Sn\n0.322198 0.322198 0.322198 Sn\n0.000000 0.322198 0.000000 Sn\n0.677802 0.677802 0.677802 Sn\n0.322198 0.000000 0.000000 Sn\n0.000000 0.000000 0.677802 Sn\n0.345104 0.000000 0.345104 Ru\n0.000000 0.345104 0.345104 Ru\n0.000000 0.654896 0.654896 Ru\n0.345104 0.345104 0.000000 Ru\n0.654896 0.654896 0.000000 Ru\n0.654896 0.000000 0.654896 Ru\n",
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"elements": [
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],
"chemical_system": "Ru-Sn",
"density": 8.847103265330007,
"density_atomic": 0.04697534888684764,
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"formula_full": "Sn14 Ru6",
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"updated_at": "2021-11-28T01:37:11.433000Z",
"spacegroup": 229
}
]
}