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"results": [
{
"id": "mp-1097480",
"created_at": "2022-09-04T14:48:09.759013Z",
"structure_string": "Mg1 Sc2 Ir1\n1.0\n-5.452479 5.921200 8.334032\n5.452479 -5.921200 8.334032\n5.452479 5.921200 -8.334032\nMg Sc Ir\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.000000 0.290354 0.290354 Sc\n0.000000 0.709646 0.709646 Sc\n0.000000 0.500000 0.500000 Ir\n",
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"formula_full": "Mg1 Sc2 Ir1",
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{
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"structure_string": "Tb2 As3 Au1\n1.0\n8.381022 0.000000 0.000000\n0.000000 8.381022 0.000000\n0.000000 0.000000 37.018137\nTb As Au\n2 3 1\ndirect\n0.500000 0.500000 0.243239 Tb\n0.500000 0.500000 0.756761 Tb\n0.500000 0.500000 0.691128 As\n0.500000 0.500000 0.308872 As\n0.500000 0.500000 0.000000 As\n0.500000 0.500000 0.500000 Au\n",
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"updated_at": "2021-11-28T01:37:59.372000Z",
"spacegroup": 123
},
{
"id": "mp-1097231",
"created_at": "2022-09-04T14:42:57.468094Z",
"structure_string": "Y2 Be1 Pd1\n1.0\n-5.192063 5.931633 8.381051\n5.192063 -5.931633 8.381051\n5.192063 5.931633 -8.381051\nY Be Pd\n2 1 1\ndirect\n0.000000 0.253789 0.253789 Y\n0.000000 0.746211 0.746211 Y\n0.000000 0.000000 0.000000 Be\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Be-Pd-Y",
"density": 0.4716342724832532,
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"volume": 1032.4587302330342,
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"formula_full": "Y2 Be1 Pd1",
"formula_reduced": "Y2BePd",
"formula_anonymous": "ABC2",
"energy": -12.87649868,
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"updated_at": "2021-11-28T01:35:57.198000Z",
"spacegroup": 71
},
{
"id": "mp-1093797",
"created_at": "2022-09-04T14:39:45.425764Z",
"structure_string": "Ti1 Be2 Pd1\n1.0\n-4.601643 4.836918 6.816033\n4.601643 -4.836918 6.816033\n4.601643 4.836918 -6.816033\nTi Be Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.000000 0.272120 0.272120 Be\n0.000000 0.727880 0.727880 Be\n0.000000 0.500000 0.500000 Pd\n",
"nsites": 4,
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"elements": [
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"chemical_system": "Be-Pd-Ti",
"density": 0.4715086826128132,
"density_atomic": 0.006591536602862232,
"volume": 606.8387753870754,
"volume_molar": 91.36171310017478,
"formula_full": "Ti1 Be2 Pd1",
"formula_reduced": "TiBe2Pd",
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"updated_at": "2021-11-28T01:34:39.071000Z",
"spacegroup": 71
},
{
"id": "mp-1209898",
"created_at": "2022-09-04T14:47:40.972020Z",
"structure_string": "Pr2 Cu1 Sb3\n1.0\n8.690901 0.000000 0.000000\n0.000000 8.690901 0.000000\n0.000000 0.000000 33.176279\nPr Cu Sb\n2 1 3\ndirect\n0.500000 0.500000 0.255995 Pr\n0.500000 0.500000 0.744005 Pr\n0.500000 0.500000 0.000000 Cu\n0.500000 0.500000 0.662101 Sb\n0.500000 0.500000 0.337899 Sb\n0.500000 0.500000 0.500000 Sb\n",
"nsites": 6,
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"elements": [
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"chemical_system": "Cu-Pr-Sb",
"density": 0.4709147143961771,
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"volume": 2505.8627494842835,
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"formula_full": "Pr2 Cu1 Sb3",
"formula_reduced": "Pr2CuSb3",
"formula_anonymous": "AB2C3",
"energy": -12.5539481,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:38:21.510000Z",
"spacegroup": 123
},
{
"id": "mp-1096161",
"created_at": "2022-09-04T14:46:59.783985Z",
"structure_string": "Sc2 Tl1 Fe1\n1.0\n-5.057680 6.333049 9.645286\n5.057680 -6.333049 9.645286\n5.057680 6.333049 -9.645286\nSc Tl Fe\n2 1 1\ndirect\n0.000000 0.203886 0.203886 Sc\n0.000000 0.796114 0.796114 Sc\n0.000000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Fe\n",
"nsites": 4,
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"elements": [
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"Tl",
"Fe"
],
"chemical_system": "Fe-Sc-Tl",
"density": 0.470491391141996,
"density_atomic": 0.0032368359871883376,
"volume": 1235.7746935069704,
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"formula_full": "Sc2 Tl1 Fe1",
"formula_reduced": "Sc2TlFe",
"formula_anonymous": "ABC2",
"energy": -14.40562772,
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"updated_at": "2021-11-28T01:37:49.610000Z",
"spacegroup": 71
},
{
"id": "mp-1093712",
"created_at": "2022-09-04T14:44:59.063950Z",
"structure_string": "Sc2 Al1 Hg1\n1.0\n-5.766908 5.874434 8.273620\n5.766908 -5.874434 8.273620\n5.766908 5.874434 -8.273620\nSc Al Hg\n2 1 1\ndirect\n0.000000 0.241612 0.241612 Sc\n0.000000 0.758388 0.758388 Sc\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Hg\n",
"nsites": 4,
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"elements": [
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"Hg"
],
"chemical_system": "Al-Hg-Sc",
"density": 0.4702247187840198,
"density_atomic": 0.0035677579110123476,
"volume": 1121.152303426609,
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"formula_full": "Sc2 Al1 Hg1",
"formula_reduced": "Sc2AlHg",
"formula_anonymous": "ABC2",
"energy": -8.60337506,
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"updated_at": "2021-11-28T01:36:49.578000Z",
"spacegroup": 71
},
{
"id": "mp-1096293",
"created_at": "2022-09-04T14:46:52.707696Z",
"structure_string": "Ti2 Ga1 Cu1\n1.0\n-5.151090 5.304148 7.414726\n5.151090 -5.304148 7.414726\n5.151090 5.304148 -7.414726\nTi Ga Cu\n2 1 1\ndirect\n0.000000 0.242826 0.242826 Ti\n0.000000 0.757174 0.757174 Ti\n0.000000 0.500000 0.500000 Ga\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 4,
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"Cu"
],
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"volume": 810.3448377048326,
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"formula_full": "Ti2 Ga1 Cu1",
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"formula_anonymous": "ABC2",
"energy": -12.47705554,
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"energy_uncorrected": -12.47705554,
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"updated_at": "2021-11-28T01:37:39.241000Z",
"spacegroup": 71
},
{
"id": "mp-1093705",
"created_at": "2022-09-04T14:42:47.106344Z",
"structure_string": "K2 Hg1 Se1\n1.0\n-6.365558 6.783296 7.330611\n6.365558 -6.783296 7.330611\n6.365558 6.783296 -7.330611\nK Hg Se\n2 1 1\ndirect\n0.209359 0.000000 0.209359 K\n0.790641 0.000000 0.790641 K\n0.500000 0.000000 0.500000 Hg\n0.000000 0.000000 0.000000 Se\n",
"nsites": 4,
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"density": 0.46918832695965723,
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"volume": 1266.127418584313,
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"formula_full": "K2 Hg1 Se1",
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"updated_at": "2021-11-28T01:35:50.179000Z",
"spacegroup": 71
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{
"id": "mp-1096100",
"created_at": "2022-09-04T14:45:19.590352Z",
"structure_string": "Al2 Tc1 Ni1\n1.0\n-4.767192 5.358389 7.300567\n4.767192 -5.358389 7.300567\n4.767192 5.358389 -7.300567\nAl Tc Ni\n2 1 1\ndirect\n0.000000 0.244486 0.244486 Al\n0.000000 0.755514 0.755514 Al\n0.000000 0.500000 0.500000 Tc\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
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"volume": 745.9564347277754,
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"formula_full": "Al2 Tc1 Ni1",
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"updated_at": "2021-11-28T01:37:04.969000Z",
"spacegroup": 71
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{
"id": "mp-1096278",
"created_at": "2022-09-04T14:47:38.543073Z",
"structure_string": "Na1 Li1 Tl2\n1.0\n-6.181795 6.839335 9.206058\n6.181795 -6.839335 9.206058\n6.181795 6.839335 -9.206058\nNa Li Tl\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Li\n0.000000 0.237326 0.237326 Tl\n0.000000 0.762674 0.762674 Tl\n",
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"volume": 1556.9052157716342,
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"formula_full": "Na1 Li1 Tl2",
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{
"id": "mp-1093664",
"created_at": "2022-09-04T14:44:09.144332Z",
"structure_string": "Sr2 Ag1 Pb1\n1.0\n-6.448588 6.912428 9.764245\n6.448588 -6.912428 9.764245\n6.448588 6.912428 -9.764245\nSr Ag Pb\n2 1 1\ndirect\n0.000000 0.246414 0.246414 Sr\n0.000000 0.753586 0.753586 Sr\n0.000000 0.000000 0.000000 Ag\n0.000000 0.500000 0.500000 Pb\n",
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"volume": 1740.9805161212362,
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"formula_full": "Sr2 Ag1 Pb1",
"formula_reduced": "Sr2AgPb",
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"updated_at": "2021-11-28T01:36:31.877000Z",
"spacegroup": 71
}
]
}