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{
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"results": [
{
"id": "mp-1095861",
"created_at": "2022-09-04T14:42:17.092292Z",
"structure_string": "Hf2 Ir1 Os1\n1.0\n-4.773553 5.493590 7.819510\n4.773553 -5.493590 7.819510\n4.773553 5.493590 -7.819510\nHf Ir Os\n2 1 1\ndirect\n0.000000 0.246980 0.246980 Hf\n0.000000 0.753020 0.753020 Hf\n0.000000 0.500000 0.500000 Ir\n0.000000 0.000000 0.000000 Os\n",
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"density": 1.4969485666756737,
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"volume": 820.2335389021162,
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"formula_full": "Hf2 Ir1 Os1",
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{
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"created_at": "2022-09-04T14:43:19.853492Z",
"structure_string": "Zr2 Re1 Rh1\n1.0\n-4.622675 5.616082 7.892704\n4.622675 -5.616082 7.892704\n4.622675 5.616082 -7.892704\nZr Re Rh\n2 1 1\ndirect\n0.000000 0.251608 0.251608 Zr\n0.000000 0.748392 0.748392 Zr\n0.000000 0.500000 0.500000 Re\n0.000000 0.000000 0.000000 Rh\n",
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"chemical_system": "Re-Rh-Zr",
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"volume": 819.6201155383167,
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"formula_full": "Zr2 Re1 Rh1",
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"updated_at": "2021-11-28T01:36:13.202000Z",
"spacegroup": 71
},
{
"id": "mp-1097312",
"created_at": "2022-09-04T14:47:28.575570Z",
"structure_string": "Zr2 Tc1 Ir1\n1.0\n-4.590601 5.647918 7.901044\n4.590601 -5.647918 7.901044\n4.590601 5.647918 -7.901044\nZr Tc Ir\n2 1 1\ndirect\n0.000000 0.241902 0.241902 Zr\n0.000000 0.758098 0.758098 Zr\n0.000000 0.000000 0.000000 Tc\n0.000000 0.500000 0.500000 Ir\n",
"nsites": 4,
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"elements": [
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"Tc",
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],
"chemical_system": "Ir-Tc-Zr",
"density": 0.9578558166682255,
"density_atomic": 0.0048815482912881,
"volume": 819.4121539550549,
"volume_molar": 123.36538328930328,
"formula_full": "Zr2 Tc1 Ir1",
"formula_reduced": "Zr2TcIr",
"formula_anonymous": "ABC2",
"energy": -23.70277955,
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"band_gap": 0.0,
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"total_magnetization": 5.41e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:08.628000Z",
"spacegroup": 71
},
{
"id": "mp-1093888",
"created_at": "2022-09-04T14:48:21.068190Z",
"structure_string": "Nb2 Cr1 Tc1\n1.0\n-4.886170 5.417868 7.736346\n4.886170 -5.417868 7.736346\n4.886170 5.417868 -7.736346\nNb Cr Tc\n2 1 1\ndirect\n0.000000 0.269760 0.269760 Nb\n0.000000 0.730240 0.730240 Nb\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.500000 Tc\n",
"nsites": 4,
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"elements": [
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"Cr",
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],
"chemical_system": "Cr-Nb-Tc",
"density": 0.6806884460782294,
"density_atomic": 0.004882779611479417,
"volume": 819.2055178153031,
"volume_molar": 123.33427349131108,
"formula_full": "Nb2 Cr1 Tc1",
"formula_reduced": "Nb2CrTc",
"formula_anonymous": "ABC2",
"energy": -24.40069443,
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"energy_uncorrected": -24.40069443,
"band_gap": 0.0,
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"is_magnetic": true,
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"updated_at": "2021-11-28T01:39:32.871000Z",
"spacegroup": 71
},
{
"id": "mp-1096439",
"created_at": "2022-09-04T14:40:43.432249Z",
"structure_string": "Li1 Zn2 Ru1\n1.0\n-5.108648 5.307352 7.549837\n5.108648 -5.307352 7.549837\n5.108648 5.307352 -7.549837\nLi Zn Ru\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.256336 0.256336 Zn\n0.000000 0.743664 0.743664 Zn\n0.000000 0.500000 0.500000 Ru\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Li-Ru-Zn",
"density": 0.4843448865138712,
"density_atomic": 0.0048851573033103,
"volume": 818.8067961065458,
"volume_molar": 123.27424453495595,
"formula_full": "Li1 Zn2 Ru1",
"formula_reduced": "LiZn2Ru",
"formula_anonymous": "ABC2",
"energy": -6.57950841,
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"energy_above_hull": null,
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"energy_uncorrected": -6.57950841,
"band_gap": 0.0463999999999997,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:09.901000Z",
"spacegroup": 71
},
{
"id": "mp-1097091",
"created_at": "2022-09-04T14:40:42.033394Z",
"structure_string": "Hf1 Zn1 Rh2\n1.0\n-4.745368 5.522804 7.809730\n4.745368 -5.522804 7.809730\n4.745368 5.522804 -7.809730\nHf Zn Rh\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Zn\n0.000000 0.266502 0.266502 Rh\n0.000000 0.733498 0.733498 Rh\n",
"nsites": 4,
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"elements": [
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"Zn",
"Rh"
],
"chemical_system": "Hf-Rh-Zn",
"density": 0.9121286631227623,
"density_atomic": 0.004885786131021456,
"volume": 818.7014111409196,
"volume_molar": 123.25837845753125,
"formula_full": "Hf1 Zn1 Rh2",
"formula_reduced": "HfZnRh2",
"formula_anonymous": "ABC2",
"energy": -18.5061165,
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"energy_uncorrected": -18.5061165,
"band_gap": 0.4142999999999999,
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"total_magnetization": 6.38e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:06.856000Z",
"spacegroup": 71
},
{
"id": "mp-1093863",
"created_at": "2022-09-04T14:43:56.976133Z",
"structure_string": "Hf2 Tc1 Ni1\n1.0\n-4.671267 5.559272 7.878087\n4.671267 -5.559272 7.878087\n4.671267 5.559272 -7.878087\nHf Tc Ni\n2 1 1\ndirect\n0.000000 0.258271 0.258271 Hf\n0.000000 0.741729 0.741729 Hf\n0.000000 0.500000 0.500000 Tc\n0.000000 0.000000 0.000000 Ni\n",
"nsites": 4,
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"elements": [
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"Tc",
"Ni"
],
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"density": 1.0423241391039026,
"density_atomic": 0.0048879484009868735,
"volume": 818.3392441688629,
"volume_molar": 123.20385294542255,
"formula_full": "Hf2 Tc1 Ni1",
"formula_reduced": "Hf2TcNi",
"formula_anonymous": "ABC2",
"energy": -22.96356692,
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"energy_uncorrected": -22.96356692,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:33.888000Z",
"spacegroup": 71
},
{
"id": "mp-1093964",
"created_at": "2022-09-04T14:48:01.363749Z",
"structure_string": "Ti2 Zn1 Mo1\n1.0\n-5.008543 5.375314 7.597568\n5.008543 -5.375314 7.597568\n5.008543 5.375314 -7.597568\nTi Zn Mo\n2 1 1\ndirect\n0.000000 0.285226 0.285226 Ti\n0.000000 0.714774 0.714774 Ti\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Mo\n",
"nsites": 4,
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"Mo"
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"density": 0.5217622137865755,
"density_atomic": 0.004888888795848535,
"volume": 818.1818337526215,
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"formula_full": "Ti2 Zn1 Mo1",
"formula_reduced": "Ti2ZnMo",
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"energy": -15.67343542,
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"updated_at": "2021-11-28T01:38:27.909000Z",
"spacegroup": 71
},
{
"id": "mp-1095964",
"created_at": "2022-09-04T14:46:53.204538Z",
"structure_string": "Zn2 Ag1 Pd1\n1.0\n-4.942607 5.410266 7.649045\n4.942607 -5.410266 7.649045\n4.942607 5.410266 -7.649045\nZn Ag Pd\n2 1 1\ndirect\n0.000000 0.243881 0.243881 Zn\n0.000000 0.756119 0.756119 Zn\n0.000000 0.500000 0.500000 Ag\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
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"elements": [
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"density": 0.7004222826527714,
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"volume": 818.1668993388719,
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"formula_full": "Zn2 Ag1 Pd1",
"formula_reduced": "Zn2AgPd",
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"updated_at": "2021-11-28T01:37:38.903000Z",
"spacegroup": 71
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{
"id": "mp-1097155",
"created_at": "2022-09-04T14:42:06.578248Z",
"structure_string": "Zr1 Sc1 Pt2\n1.0\n-4.912833 5.573798 7.468142\n4.912833 -5.573798 7.468142\n4.912833 5.573798 -7.468142\nZr Sc Pt\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Sc\n0.000000 0.240546 0.240546 Pt\n0.000000 0.759454 0.759454 Pt\n",
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"formula_full": "Zr1 Sc1 Pt2",
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"updated_at": "2021-11-28T01:35:32.274000Z",
"spacegroup": 71
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{
"id": "mp-1097342",
"created_at": "2022-09-04T14:45:23.487952Z",
"structure_string": "Zr2 Os1 Rh1\n1.0\n-4.660358 5.576981 7.867393\n4.660358 -5.576981 7.867393\n4.660358 5.576981 -7.867393\nZr Os Rh\n2 1 1\ndirect\n0.000000 0.252241 0.252241 Zr\n0.000000 0.747759 0.747759 Zr\n0.000000 0.500000 0.500000 Os\n0.000000 0.000000 0.000000 Rh\n",
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},
{
"id": "mp-1095717",
"created_at": "2022-09-04T14:41:20.011041Z",
"structure_string": "Al1 Zn1 Au2\n1.0\n-4.940769 5.407479 7.646622\n4.940769 -5.407479 7.646622\n4.940769 5.407479 -7.646622\nAl Zn Au\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.000000 0.500000 0.500000 Zn\n0.000000 0.243483 0.243483 Au\n0.000000 0.756517 0.756517 Au\n",
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"volume": 817.1823995898321,
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"formula_full": "Al1 Zn1 Au2",
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"total_magnetization": 4.78e-05,
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"updated_at": "2021-11-28T01:35:18.672000Z",
"spacegroup": 71
}
]
}