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{
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"results": [
{
"id": "mp-1097358",
"created_at": "2022-09-04T14:40:40.693068Z",
"structure_string": "Mg1 Zn2 Pd1\n1.0\n-5.295738 5.593849 7.899852\n5.295738 -5.593849 7.899852\n5.295738 5.593849 -7.899852\nMg Zn Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.271258 0.271258 Zn\n0.000000 0.728742 0.728742 Zn\n0.000000 0.500000 0.500000 Pd\n",
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"volume": 936.0869182649996,
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"formula_full": "Mg1 Zn2 Pd1",
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{
"id": "mp-1096303",
"created_at": "2022-09-04T14:39:44.885388Z",
"structure_string": "Mg2 Zn1 Ga1\n1.0\n-5.327614 5.571841 7.876203\n5.327614 -5.571841 7.876203\n5.327614 5.571841 -7.876203\nMg Zn Ga\n2 1 1\ndirect\n0.000000 0.252483 0.252483 Mg\n0.000000 0.747517 0.747517 Mg\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ga\n",
"nsites": 4,
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],
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"formula_full": "Mg2 Zn1 Ga1",
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"updated_at": "2021-11-28T01:34:40.439000Z",
"spacegroup": 71
},
{
"id": "mp-1096143",
"created_at": "2022-09-04T14:40:41.908990Z",
"structure_string": "Ta1 Tc2 Sn1\n1.0\n-4.828490 5.864109 8.249812\n4.828490 -5.864109 8.249812\n4.828490 5.864109 -8.249812\nTa Tc Sn\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Ta\n0.000000 0.269967 0.269967 Tc\n0.000000 0.730033 0.730033 Tc\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 4,
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"elements": [
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"Sn"
],
"chemical_system": "Sn-Ta-Tc",
"density": 0.8808738120971263,
"density_atomic": 0.004280973876642407,
"volume": 934.3668322351978,
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"formula_full": "Ta1 Tc2 Sn1",
"formula_reduced": "TaTc2Sn",
"formula_anonymous": "ABC2",
"energy": -22.76754991,
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"energy_uncorrected": -22.76754991,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:05.394000Z",
"spacegroup": 71
},
{
"id": "mp-1097421",
"created_at": "2022-09-04T14:40:07.764644Z",
"structure_string": "Sc1 Ga2 Ir1\n1.0\n-5.156374 5.700587 7.946542\n5.156374 -5.700587 7.946542\n5.156374 5.700587 -7.946542\nSc Ga Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.270357 0.270357 Ga\n0.000000 0.729643 0.729643 Ga\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 4,
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"elements": [
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"Ga",
"Ir"
],
"chemical_system": "Ga-Ir-Sc",
"density": 0.6693435141106767,
"density_atomic": 0.004281124215196636,
"volume": 934.33402044287,
"volume_molar": 140.66727469909202,
"formula_full": "Sc1 Ga2 Ir1",
"formula_reduced": "ScGa2Ir",
"formula_anonymous": "ABC2",
"energy": -12.66218409,
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"energy_uncorrected": -12.66218409,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 0.646828,
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"updated_at": "2021-11-28T01:34:46.773000Z",
"spacegroup": 71
},
{
"id": "mp-1097273",
"created_at": "2022-09-04T14:39:27.578603Z",
"structure_string": "Mg2 Zn1 Ir1\n1.0\n-5.268767 5.592930 7.919557\n5.268767 -5.592930 7.919557\n5.268767 5.592930 -7.919557\nMg Zn Ir\n2 1 1\ndirect\n0.000000 0.261691 0.261691 Mg\n0.000000 0.738309 0.738309 Mg\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Ir-Mg-Zn",
"density": 0.5447485508383524,
"density_atomic": 0.004284999089706322,
"volume": 933.4891131270102,
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"formula_full": "Mg2 Zn1 Ir1",
"formula_reduced": "Mg2ZnIr",
"formula_anonymous": "ABC2",
"energy": -6.05601468,
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"energy_uncorrected": -6.05601468,
"band_gap": 0.0,
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"is_magnetic": true,
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"updated_at": "2021-11-28T01:34:38.916000Z",
"spacegroup": 71
},
{
"id": "mp-1097261",
"created_at": "2022-09-04T14:41:36.892481Z",
"structure_string": "Y1 Hf1 Rh2\n1.0\n-4.869637 5.864604 8.169263\n4.869637 -5.864604 8.169263\n4.869637 5.864604 -8.169263\nY Hf Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.500000 0.500000 Hf\n0.000000 0.264238 0.264238 Rh\n0.000000 0.735762 0.735762 Rh\n",
"nsites": 4,
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"elements": [
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"Hf",
"Rh"
],
"chemical_system": "Hf-Rh-Y",
"density": 0.8420191526851866,
"density_atomic": 0.004286292864812478,
"volume": 933.2073486712152,
"volume_molar": 140.49765029911143,
"formula_full": "Y1 Hf1 Rh2",
"formula_reduced": "YHfRh2",
"formula_anonymous": "ABC2",
"energy": -22.70162754,
"energy_per_atom": -5.675406885,
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"is_stable": null,
"decomposes_to": null,
"formation_energy": null,
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"energy_uncorrected": -22.70162754,
"band_gap": 0.0,
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"total_magnetization": 0.4466627,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:27.167000Z",
"spacegroup": 71
},
{
"id": "mp-1097075",
"created_at": "2022-09-04T14:40:58.345579Z",
"structure_string": "Sc1 Tl1 Cu2\n1.0\n-5.376190 5.480958 7.913708\n5.376190 -5.480958 7.913708\n5.376190 5.480958 -7.913708\nSc Tl Cu\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Tl\n0.000000 0.245176 0.245176 Cu\n0.000000 0.754824 0.754824 Cu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Tl",
"Cu"
],
"chemical_system": "Cu-Sc-Tl",
"density": 0.6701370471313226,
"density_atomic": 0.0042883368849979606,
"volume": 932.7625387812559,
"volume_molar": 140.43068260489204,
"formula_full": "Sc1 Tl1 Cu2",
"formula_reduced": "ScTlCu2",
"formula_anonymous": "ABC2",
"energy": -9.86428897,
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"energy_uncorrected": -9.86428897,
"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:12.569000Z",
"spacegroup": 71
},
{
"id": "mp-1093827",
"created_at": "2022-09-04T14:46:24.556704Z",
"structure_string": "Li1 Zr2 Ru1\n1.0\n-5.240927 5.627969 7.904926\n5.240927 -5.627969 7.904926\n5.240927 5.627969 -7.904926\nLi Zr Ru\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.288173 0.288173 Zr\n0.000000 0.711827 0.711827 Zr\n0.000000 0.500000 0.500000 Ru\n",
"nsites": 4,
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"elements": [
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"Zr",
"Ru"
],
"chemical_system": "Li-Ru-Zr",
"density": 0.5171497607480341,
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"volume": 932.6476648619487,
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"formula_full": "Li1 Zr2 Ru1",
"formula_reduced": "LiZr2Ru",
"formula_anonymous": "ABC2",
"energy": -16.63680719,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:37:37.370000Z",
"spacegroup": 71
},
{
"id": "mp-1097527",
"created_at": "2022-09-04T14:43:08.191730Z",
"structure_string": "Hf2 Fe1 Re1\n1.0\n-4.756743 5.892523 8.312963\n4.756743 -5.892523 8.312963\n4.756743 5.892523 -8.312963\nHf Fe Re\n2 1 1\ndirect\n0.000000 0.252154 0.252154 Hf\n0.000000 0.747846 0.747846 Hf\n0.000000 0.000000 0.000000 Fe\n0.000000 0.500000 0.500000 Re\n",
"nsites": 4,
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"elements": [
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"Fe",
"Re"
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"density": 1.0672650982156247,
"density_atomic": 0.004291737771545311,
"volume": 932.0233930694545,
"volume_molar": 140.3194016169266,
"formula_full": "Hf2 Fe1 Re1",
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"updated_at": "2021-11-28T01:36:03.808000Z",
"spacegroup": 71
},
{
"id": "mp-1096329",
"created_at": "2022-09-04T14:41:11.272961Z",
"structure_string": "Ag2 Pd1 Au1\n1.0\n-5.298592 5.582214 7.875646\n5.298592 -5.582214 7.875646\n5.298592 5.582214 -7.875646\nAg Pd Au\n2 1 1\ndirect\n0.000000 0.251149 0.251149 Ag\n0.000000 0.748851 0.748851 Ag\n0.000000 0.000000 0.000000 Pd\n0.000000 0.500000 0.500000 Au\n",
"nsites": 4,
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"elements": [
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"density": 0.9251373251805958,
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"volume": 931.7794741722319,
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"formula_full": "Ag2 Pd1 Au1",
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"updated_at": "2021-11-28T01:35:16.909000Z",
"spacegroup": 71
},
{
"id": "mp-1096071",
"created_at": "2022-09-04T14:43:19.302666Z",
"structure_string": "Hf2 Tc1 Pt1\n1.0\n-4.843911 5.912833 8.126666\n4.843911 -5.912833 8.126666\n4.843911 5.912833 -8.126666\nHf Tc Pt\n2 1 1\ndirect\n0.000000 0.235705 0.235705 Hf\n0.000000 0.764295 0.764295 Hf\n0.000000 0.000000 0.000000 Tc\n0.000000 0.500000 0.500000 Pt\n",
"nsites": 4,
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"density": 1.1594206814377086,
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"formula_full": "Hf2 Tc1 Pt1",
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"energy": -24.57787587,
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"updated_at": "2021-11-28T01:36:11.478000Z",
"spacegroup": 71
},
{
"id": "mp-1097157",
"created_at": "2022-09-04T14:46:29.133575Z",
"structure_string": "Zr2 Zn1 Tc1\n1.0\n-5.215415 5.586312 7.985717\n5.215415 -5.586312 7.985717\n5.215415 5.586312 -7.985717\nZr Zn Tc\n2 1 1\ndirect\n0.000000 0.284311 0.284311 Zr\n0.000000 0.715689 0.715689 Zr\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Tc\n",
"nsites": 4,
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"elements": [
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"density": 0.6171030618261684,
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"volume": 930.653395654117,
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"formula_full": "Zr2 Zn1 Tc1",
"formula_reduced": "Zr2ZnTc",
"formula_anonymous": "ABC2",
"energy": -16.84171707,
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"updated_at": "2021-11-28T01:37:36.116000Z",
"spacegroup": 71
}
]
}