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"results": [
{
"id": "mp-1096741",
"created_at": "2022-09-04T14:46:29.690946Z",
"structure_string": "Y2 Ga1 Ag1\n1.0\n-5.833653 6.150156 8.695187\n5.833653 -6.150156 8.695187\n5.833653 6.150156 -8.695187\nY Ga Ag\n2 1 1\ndirect\n0.000000 0.242423 0.242423 Y\n0.000000 0.757577 0.757577 Y\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Ag\n",
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{
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{
"id": "mp-1096310",
"created_at": "2022-09-04T14:40:03.174224Z",
"structure_string": "Li1 Y2 Zn1\n1.0\n-6.039881 6.051563 8.556729\n6.039881 -6.051563 8.556729\n6.039881 6.051563 -8.556729\nLi Y Zn\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.262781 0.262781 Y\n0.000000 0.737219 0.737219 Y\n0.000000 0.500000 0.500000 Zn\n",
"nsites": 4,
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"elements": [
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"density": 0.33205208153295074,
"density_atomic": 0.003197394925495737,
"volume": 1251.0184363227586,
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"formula_full": "Li1 Y2 Zn1",
"formula_reduced": "LiY2Zn",
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"energy_above_hull": null,
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"energy_uncorrected": -7.37909247,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.946000Z",
"spacegroup": 71
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{
"id": "mp-1096458",
"created_at": "2022-09-04T14:39:47.711976Z",
"structure_string": "Na1 Tl1 Cd2\n1.0\n-6.044578 6.146596 8.418492\n6.044578 -6.146596 8.418492\n6.044578 6.146596 -8.418492\nNa Tl Cd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.500000 0.500000 Tl\n0.000000 0.249998 0.249998 Cd\n0.000000 0.750002 0.750002 Cd\n",
"nsites": 4,
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],
"chemical_system": "Cd-Na-Tl",
"density": 0.6001778590395918,
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"volume": 1251.1084288662503,
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"formula_full": "Na1 Tl1 Cd2",
"formula_reduced": "NaTlCd2",
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"updated_at": "2021-11-28T01:34:28.332000Z",
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{
"id": "mp-1096650",
"created_at": "2022-09-04T14:44:24.633626Z",
"structure_string": "Ti2 Nb1 Zn1\n1.0\n-5.052710 6.047073 10.239034\n5.052710 -6.047073 10.239034\n5.052710 6.047073 -10.239034\nTi Nb Zn\n2 1 1\ndirect\n0.000000 0.278977 0.278977 Ti\n0.000000 0.721023 0.721023 Ti\n0.000000 0.500000 0.500000 Nb\n0.000000 0.000000 0.000000 Zn\n",
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"volume": 1251.3781296158913,
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"formula_full": "Ti2 Nb1 Zn1",
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:25.161000Z",
"spacegroup": 71
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{
"id": "mp-1093619",
"created_at": "2022-09-04T14:42:28.969851Z",
"structure_string": "Sc1 Tl1 Ag2\n1.0\n-5.721337 5.814861 9.424273\n5.721337 -5.814861 9.424273\n5.721337 5.814861 -9.424273\nSc Tl Ag\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Sc\n0.000000 0.500000 0.500000 Tl\n0.000000 0.247365 0.247365 Ag\n0.000000 0.752635 0.752635 Ag\n",
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"density_atomic": 0.0031894461549231124,
"volume": 1254.136237360755,
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"formula_full": "Sc1 Tl1 Ag2",
"formula_reduced": "ScTlAg2",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:52.841000Z",
"spacegroup": 71
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{
"id": "mp-1096488",
"created_at": "2022-09-04T14:44:25.847911Z",
"structure_string": "Sc2 Hg1 Os1\n1.0\n-5.406882 6.949424 8.345343\n5.406882 -6.949424 8.345343\n5.406882 6.949424 -8.345343\nSc Hg Os\n2 1 1\ndirect\n0.000000 0.207590 0.207590 Sc\n0.000000 0.792410 0.792410 Sc\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Os\n",
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"Os"
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"chemical_system": "Hg-Os-Sc",
"density": 0.6364321150553386,
"density_atomic": 0.003189041033715511,
"volume": 1254.2955571003272,
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"formula_full": "Sc2 Hg1 Os1",
"formula_reduced": "Sc2HgOs",
"formula_anonymous": "ABC2",
"energy": -15.52737827,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:36:38.280000Z",
"spacegroup": 71
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{
"id": "mp-1215120",
"created_at": "2022-09-04T14:45:18.266104Z",
"structure_string": "Co1 Sn3 F6\n1.0\n12.621503 0.000000 0.000000\n-6.247302 -11.397261 0.000000\n-2.816187 1.343452 -21.804956\nCo Sn F\n1 3 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.500000 Sn\n0.500000 0.000000 0.000000 Sn\n0.000000 0.500000 0.000000 Sn\n0.005063 0.599414 0.073740 F\n0.994937 0.400586 0.926260 F\n0.929569 0.004900 0.410734 F\n0.070431 0.995100 0.589266 F\n0.606470 0.920349 0.995816 F\n0.393530 0.079651 0.004184 F\n",
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"Sn",
"F"
],
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"density": 0.28007993677071985,
"density_atomic": 0.0031881094063000463,
"volume": 3136.6552164862746,
"volume_molar": 188.8937922926862,
"formula_full": "Co1 Sn3 F6",
"formula_reduced": "CoSn3F6",
"formula_anonymous": "AB3C6",
"energy": -41.66677283999999,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:36:56.793000Z",
"spacegroup": 2
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{
"id": "mp-1096436",
"created_at": "2022-09-04T14:42:47.916118Z",
"structure_string": "Tl2 In1 Sn1\n1.0\n-5.679481 6.254464 8.846872\n5.679481 -6.254464 8.846872\n5.679481 6.254464 -8.846872\nTl In Sn\n2 1 1\ndirect\n0.000000 0.257750 0.257750 Tl\n0.000000 0.742250 0.742250 Tl\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 Sn\n",
"nsites": 4,
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"In",
"Sn"
],
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"volume": 1257.0382220092351,
"volume_molar": 189.25152784099362,
"formula_full": "Tl2 In1 Sn1",
"formula_reduced": "Tl2InSn",
"formula_anonymous": "ABC2",
"energy": -7.17720997,
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"updated_at": "2021-11-28T01:35:51.352000Z",
"spacegroup": 71
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{
"id": "mp-1096443",
"created_at": "2022-09-04T14:39:20.425879Z",
"structure_string": "Mg2 Hg1 Pt1\n1.0\n-5.255245 6.555867 9.124055\n5.255245 -6.555867 9.124055\n5.255245 6.555867 -9.124055\nMg Hg Pt\n2 1 1\ndirect\n0.000000 0.232476 0.232476 Mg\n0.000000 0.767524 0.767524 Mg\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
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"volume": 1257.392854285258,
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"formula_full": "Mg2 Hg1 Pt1",
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"spacegroup": 71
},
{
"id": "mp-1096695",
"created_at": "2022-09-04T14:39:22.320335Z",
"structure_string": "Tl2 Hg1 Sb1\n1.0\n-5.732499 6.236931 8.799023\n5.732499 -6.236931 8.799023\n5.732499 6.236931 -8.799023\nTl Hg Sb\n2 1 1\ndirect\n0.000000 0.239533 0.239533 Tl\n0.000000 0.760467 0.760467 Tl\n0.000000 0.500000 0.500000 Hg\n0.000000 0.000000 0.000000 Sb\n",
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{
"id": "mp-1095712",
"created_at": "2022-09-04T14:40:00.274662Z",
"structure_string": "Sc2 Be1 Tl1\n1.0\n-5.537367 6.390839 8.892176\n5.537367 -6.390839 8.892176\n5.537367 6.390839 -8.892176\nSc Be Tl\n2 1 1\ndirect\n0.000000 0.232797 0.232797 Sc\n0.000000 0.767203 0.767203 Sc\n0.000000 0.000000 0.000000 Be\n0.000000 0.500000 0.500000 Tl\n",
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"updated_at": "2021-11-28T01:35:02.592000Z",
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}
]
}