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{
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"results": [
{
"id": "mp-1095866",
"created_at": "2022-09-04T14:41:48.995358Z",
"structure_string": "Sr2 In1 Pb1\n1.0\n-6.573448 7.141582 9.877578\n6.573448 -7.141582 9.877578\n6.573448 7.141582 -9.877578\nSr In Pb\n2 1 1\ndirect\n0.000000 0.252360 0.252360 Sr\n0.000000 0.747640 0.747640 Sr\n0.000000 0.000000 0.000000 In\n0.000000 0.500000 0.500000 Pb\n",
"nsites": 4,
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"volume": 1854.8044025944087,
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{
"id": "mp-975055",
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"nsites": 4,
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"elements": [
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"chemical_system": "Ac-Rb",
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"volume": 286.8014356391224,
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"formula_full": "Rb3 Ac1",
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"updated_at": "2021-11-28T01:35:15.786000Z",
"spacegroup": 139
},
{
"id": "mp-23231",
"created_at": "2022-09-04T14:42:48.448871Z",
"structure_string": "Ag1 Br1\n1.0\n0.000000 2.925814 2.925814\n2.925814 0.000000 2.925814\n2.925814 2.925814 0.000000\nAg Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.500000 Br\n",
"nsites": 2,
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"elements": [
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"density": 6.224582901346875,
"density_atomic": 0.03992637293183357,
"volume": 50.0922035521385,
"volume_molar": 15.083115038477503,
"formula_full": "Ag1 Br1",
"formula_reduced": "AgBr",
"formula_anonymous": "AB",
"energy": -5.66352725,
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"energy_above_hull": null,
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"energy_uncorrected": -5.12952725,
"band_gap": 0.7303999999999999,
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"is_theoretical": false,
"updated_at": "2021-11-28T01:35:52.807000Z",
"spacegroup": 225
},
{
"id": "mp-1096341",
"created_at": "2022-09-04T14:40:40.627360Z",
"structure_string": "Cd1 In2 Ga1\n1.0\n-5.819324 5.899212 8.355359\n5.819324 -5.899212 8.355359\n5.819324 5.899212 -8.355359\nCd In Ga\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Cd\n0.000000 0.234774 0.234774 In\n0.000000 0.765226 0.765226 In\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
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"elements": [
"Cd",
"In",
"Ga"
],
"chemical_system": "Cd-Ga-In",
"density": 0.5959531947009086,
"density_atomic": 0.003486328801127628,
"volume": 1147.3387130629299,
"volume_molar": 172.73588073655534,
"formula_full": "Cd1 In2 Ga1",
"formula_reduced": "CdIn2Ga",
"formula_anonymous": "ABC2",
"energy": -5.12743557,
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"energy_above_hull": null,
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"energy_uncorrected": -5.12743557,
"band_gap": 0.0,
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"updated_at": "2021-11-28T01:35:08.789000Z",
"spacegroup": 71
},
{
"id": "mp-1095901",
"created_at": "2022-09-04T14:48:04.025214Z",
"structure_string": "Sr1 Ca1 Ag2\n1.0\n-6.171157 6.543149 9.253444\n6.171157 -6.543149 9.253444\n6.171157 6.543149 -9.253444\nSr Ca Ag\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Ca\n0.000000 0.242091 0.242091 Ag\n0.000000 0.757909 0.757909 Ag\n",
"nsites": 4,
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"elements": [
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"Ca",
"Ag"
],
"chemical_system": "Ag-Ca-Sr",
"density": 0.38157164428836043,
"density_atomic": 0.0026763517605962062,
"volume": 1494.5718492209435,
"volume_molar": 225.01305129855047,
"formula_full": "Sr1 Ca1 Ag2",
"formula_reduced": "SrCaAg2",
"formula_anonymous": "ABC2",
"energy": -5.12442851,
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"energy_above_hull": null,
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"energy_uncorrected": -5.12442851,
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"total_magnetization": 4.75e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:27.005000Z",
"spacegroup": 71
},
{
"id": "mp-30717",
"created_at": "2022-09-04T14:41:06.994280Z",
"structure_string": "K2 Hg4\n1.0\n-2.649394 4.117988 4.720714\n2.649394 -4.117988 4.720714\n2.649394 4.117988 -4.720714\nK Hg\n2 4\ndirect\n0.700862 0.950862 0.750000 K\n0.299138 0.049138 0.250000 K\n0.282874 0.336990 0.945883 Hg\n0.717126 0.663010 0.054117 Hg\n0.891107 0.336990 0.554117 Hg\n0.108893 0.663010 0.445883 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
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"Hg"
],
"chemical_system": "Hg-K",
"density": 7.097527233874118,
"density_atomic": 0.029124061802565018,
"volume": 206.0152200154845,
"volume_molar": 20.67754422726028,
"formula_full": "K2 Hg4",
"formula_reduced": "KHg2",
"formula_anonymous": "AB2",
"energy": -5.12057237,
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"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 8.1e-06,
"is_theoretical": false,
"updated_at": "2021-11-28T01:35:14.746000Z",
"spacegroup": 74
},
{
"id": "mp-34",
"created_at": "2022-09-04T14:44:07.263097Z",
"structure_string": "Si1\n1.0\n1.324762 -2.294556 0.000000\n1.324762 2.294556 0.000000\n0.000000 0.000000 2.476905\nSi\n1\ndirect\n0.000000 0.000000 0.000000 Si\n",
"nsites": 1,
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"elements": [
"Si"
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"chemical_system": "Si",
"density": 3.097101142265708,
"density_atomic": 0.06640857037662255,
"volume": 15.05829736024591,
"volume_molar": 9.06831863093373,
"formula_full": "Si1",
"formula_reduced": "Si",
"formula_anonymous": "A",
"energy": -5.1200173,
"energy_per_atom": -5.1200173,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -5.1200173,
"band_gap": 0.0,
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"is_magnetic": false,
"total_magnetization": 0.0001319,
"is_theoretical": false,
"updated_at": "2021-11-28T01:36:34.599000Z",
"spacegroup": 191
},
{
"id": "mp-1096593",
"created_at": "2022-09-04T14:45:19.777629Z",
"structure_string": "La1 Y1 Hg2\n1.0\n-6.140412 6.351773 8.983111\n6.140412 -6.351773 8.983111\n6.140412 6.351773 -8.983111\nLa Y Hg\n1 1 2\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Y\n0.000000 0.246129 0.246129 Hg\n0.000000 0.753871 0.753871 Hg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"La",
"Y",
"Hg"
],
"chemical_system": "Hg-La-Y",
"density": 0.7452714966998385,
"density_atomic": 0.002854176022075029,
"volume": 1401.4552603143024,
"volume_molar": 210.9940211613793,
"formula_full": "La1 Y1 Hg2",
"formula_reduced": "LaYHg2",
"formula_anonymous": "ABC2",
"energy": -5.11738187,
"energy_per_atom": -1.2793454675,
"energy_above_hull": null,
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"band_gap": 0.0,
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"updated_at": "2021-11-28T01:36:54.764000Z",
"spacegroup": 71
},
{
"id": "mp-1093582",
"created_at": "2022-09-04T14:48:20.475609Z",
"structure_string": "Ba2 Cd1 Ge1\n1.0\n-6.775685 6.975361 9.852347\n6.775685 -6.975361 9.852347\n6.775685 6.975361 -9.852347\nBa Cd Ge\n2 1 1\ndirect\n0.000000 0.216915 0.216915 Ba\n0.000000 0.783085 0.783085 Ba\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
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"Cd",
"Ge"
],
"chemical_system": "Ba-Cd-Ge",
"density": 0.4098347106356397,
"density_atomic": 0.0021475357602241505,
"volume": 1862.5999501784768,
"volume_molar": 280.42097698859436,
"formula_full": "Ba2 Cd1 Ge1",
"formula_reduced": "Ba2CdGe",
"formula_anonymous": "ABC2",
"energy": -5.11463111,
"energy_per_atom": -1.2786577775,
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"band_gap": 0.0671000000000001,
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"updated_at": "2021-11-28T01:39:07.151000Z",
"spacegroup": 71
},
{
"id": "mp-1097393",
"created_at": "2022-09-04T14:44:15.831169Z",
"structure_string": "Mg2 Cd1 Rh1\n1.0\n-5.614682 6.388539 9.283333\n5.614682 -6.388539 9.283333\n5.614682 6.388539 -9.283333\nMg Cd Rh\n2 1 1\ndirect\n0.000000 0.223293 0.223293 Mg\n0.000000 0.776707 0.776707 Mg\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Cd-Mg-Rh",
"density": 0.3290345181343499,
"density_atomic": 0.0030030969740266152,
"volume": 1331.9583198929192,
"volume_molar": 200.5310122212067,
"formula_full": "Mg2 Cd1 Rh1",
"formula_reduced": "Mg2CdRh",
"formula_anonymous": "ABC2",
"energy": -5.11162325,
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"updated_at": "2021-11-28T01:36:36.580000Z",
"spacegroup": 71
},
{
"id": "mp-975015",
"created_at": "2022-09-04T14:45:55.293943Z",
"structure_string": "Rb3 Ga1\n1.0\n-3.134327 3.134327 5.635995\n3.134327 -3.134327 5.635995\n3.134327 3.134327 -5.635995\nRb Ga\n3 1\ndirect\n0.750000 0.250000 0.500000 Rb\n0.250000 0.750000 0.500000 Rb\n0.500000 0.500000 0.000000 Rb\n0.000000 0.000000 0.000000 Ga\n",
"nsites": 4,
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"density": 2.4452082689163084,
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"volume": 221.47218898847652,
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"formula_full": "Rb3 Ga1",
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"updated_at": "2021-11-28T01:37:10.991000Z",
"spacegroup": 139
},
{
"id": "mp-1186089",
"created_at": "2022-09-04T14:41:19.685615Z",
"structure_string": "Na3 Yb1\n1.0\n0.000000 4.250866 4.250866\n4.250866 0.000000 4.250866\n4.250866 4.250866 0.000000\nNa Yb\n3 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Na\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Yb\n",
"nsites": 4,
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"density": 2.615886680797354,
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"volume": 153.62512187517694,
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"formula_full": "Na3 Yb1",
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"formula_anonymous": "AB3",
"energy": -5.10445846,
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"updated_at": "2021-11-28T01:35:15.206000Z",
"spacegroup": 225
}
]
}