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{
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{
"id": "mp-1096488",
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"updated_at": "2021-11-28T01:35:52.841000Z",
"spacegroup": 71
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{
"id": "mp-1096650",
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"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",
"nsites": 4,
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"chemical_system": "Nb-Ti-Zn",
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"density_atomic": 0.0031964758735457477,
"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-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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"elements": [
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"density_atomic": 0.0031971649360757522,
"volume": 1251.1084288662503,
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"formula_full": "Na1 Tl1 Cd2",
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"updated_at": "2021-11-28T01:34:28.332000Z",
"spacegroup": 71
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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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"volume": 1251.0184363227586,
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"formula_full": "Li1 Y2 Zn1",
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"band_gap": 0.0,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:34:46.946000Z",
"spacegroup": 71
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{
"id": "mp-1096151",
"created_at": "2022-09-04T14:45:58.259047Z",
"structure_string": "Ca2 Zn1 Ge1\n1.0\n-6.037976 6.055190 8.543541\n6.037976 -6.055190 8.543541\n6.037976 6.055190 -8.543541\nCa Zn Ge\n2 1 1\ndirect\n0.000000 0.267671 0.267671 Ca\n0.000000 0.732329 0.732329 Ca\n0.000000 0.000000 0.000000 Zn\n0.000000 0.500000 0.500000 Ge\n",
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"chemical_system": "Ca-Ge-Zn",
"density": 0.2899991591431639,
"density_atomic": 0.0032014220705213862,
"volume": 1249.444750453837,
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"formula_full": "Ca2 Zn1 Ge1",
"formula_reduced": "Ca2ZnGe",
"formula_anonymous": "ABC2",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:37:09.823000Z",
"spacegroup": 71
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{
"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",
"nsites": 4,
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"Ga",
"Ag"
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"chemical_system": "Ag-Ga-Y",
"density": 0.47293823077615643,
"density_atomic": 0.0032054894290436246,
"volume": 1247.859363926657,
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"formula_full": "Y2 Ga1 Ag1",
"formula_reduced": "Y2GaAg",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:37:33.265000Z",
"spacegroup": 71
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{
"id": "mp-1096077",
"created_at": "2022-09-04T14:42:05.417215Z",
"structure_string": "Na1 In2 Sn1\n1.0\n-5.835649 6.259854 8.532876\n5.835649 -6.259854 8.532876\n5.835649 6.259854 -8.532876\nNa In Sn\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.265363 0.265363 In\n0.000000 0.734637 0.734637 In\n0.000000 0.500000 0.500000 Sn\n",
"nsites": 4,
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"density": 0.4945464517829896,
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"volume": 1246.8344469812919,
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"formula_reduced": "NaIn2Sn",
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"band_gap": 0.0918999999999998,
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"updated_at": "2021-11-28T01:35:39.480000Z",
"spacegroup": 71
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{
"id": "mp-1096342",
"created_at": "2022-09-04T14:39:59.454229Z",
"structure_string": "In2 Hg1 Bi1\n1.0\n-5.687313 6.233473 8.789584\n5.687313 -6.233473 8.789584\n5.687313 6.233473 -8.789584\nIn Hg Bi\n2 1 1\ndirect\n0.000000 0.256774 0.256774 In\n0.000000 0.743226 0.743226 In\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Bi\n",
"nsites": 4,
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"volume": 1246.423203257388,
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"formula_full": "In2 Hg1 Bi1",
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"updated_at": "2021-11-28T01:34:55.401000Z",
"spacegroup": 71
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{
"id": "mp-1096437",
"created_at": "2022-09-04T14:41:02.576212Z",
"structure_string": "Cs2 H1 Cl1\n1.0\n-5.998022 6.059594 8.567579\n5.998022 -6.059594 8.567579\n5.998022 6.059594 -8.567579\nCs H Cl\n2 1 1\ndirect\n0.000000 0.231129 0.231129 Cs\n0.000000 0.768871 0.768871 Cs\n0.000000 0.000000 0.000000 H\n0.000000 0.500000 0.500000 Cl\n",
"nsites": 4,
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"volume": 1245.5744474802273,
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"updated_at": "2021-11-28T01:35:12.468000Z",
"spacegroup": 71
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{
"id": "mp-1096289",
"created_at": "2022-09-04T14:42:05.134165Z",
"structure_string": "Sc2 In1 Hg1\n1.0\n-5.900606 6.080014 8.674644\n5.900606 -6.080014 8.674644\n5.900606 6.080014 -8.674644\nSc In Hg\n2 1 1\ndirect\n0.000000 0.245489 0.245489 Sc\n0.000000 0.754511 0.754511 Sc\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 Hg\n",
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"volume": 1244.8380308780609,
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"spacegroup": 71
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{
"id": "mp-1096471",
"created_at": "2022-09-04T14:46:52.589781Z",
"structure_string": "Y1 Ag2 Hg1\n1.0\n-5.815003 6.150316 8.696840\n5.815003 -6.150316 8.696840\n5.815003 6.150316 -8.696840\nY Ag Hg\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.247331 0.247331 Ag\n0.000000 0.752669 0.752669 Ag\n0.000000 0.500000 0.500000 Hg\n",
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"volume": 1244.1388301852649,
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"updated_at": "2021-11-28T01:37:37.305000Z",
"spacegroup": 71
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]
}