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{
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"results": [
{
"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": [
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"chemical_system": "Cd-Ga-In",
"density": 0.5959531947009086,
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"volume": 1147.3387130629299,
"volume_molar": 172.73588073655534,
"formula_full": "Cd1 In2 Ga1",
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{
"id": "mp-975055",
"created_at": "2022-09-04T14:41:11.971809Z",
"structure_string": "Rb3 Ac1\n1.0\n-3.171003 3.171003 7.130632\n3.171003 -3.171003 7.130632\n3.171003 3.171003 -7.130632\nRb Ac\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 Ac\n",
"nsites": 4,
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"elements": [
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"density": 2.7988361663478685,
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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-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,
"nelements": 3,
"elements": [
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"In",
"Pb"
],
"chemical_system": "In-Pb-Sr",
"density": 0.44517704078360576,
"density_atomic": 0.002156561626878283,
"volume": 1854.8044025944087,
"volume_molar": 279.24732986728094,
"formula_full": "Sr2 In1 Pb1",
"formula_reduced": "Sr2InPb",
"formula_anonymous": "ABC2",
"energy": -5.13355405,
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"energy_uncorrected": -5.13355405,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 3.9646715,
"is_theoretical": true,
"updated_at": "2021-11-28T01:35:29.284000Z",
"spacegroup": 71
},
{
"id": "mp-1038975",
"created_at": "2022-09-04T14:47:16.991901Z",
"structure_string": "Mg2 Cd2\n1.0\n1.624655 -2.813984 0.000000\n1.624655 2.813984 0.000000\n0.000000 0.000000 9.783840\nMg Cd\n2 2\ndirect\n0.333333 0.666667 0.628974 Mg\n0.666667 0.333333 0.371026 Mg\n0.666667 0.333333 0.874065 Cd\n0.333333 0.666667 0.125935 Cd\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mg",
"Cd"
],
"chemical_system": "Cd-Mg",
"density": 5.075470686227626,
"density_atomic": 0.044713418921383356,
"volume": 89.45860317755918,
"volume_molar": 13.468307513206117,
"formula_full": "Mg2 Cd2",
"formula_reduced": "MgCd",
"formula_anonymous": "AB",
"energy": -5.1354222,
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"energy_above_hull": null,
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"energy_uncorrected": -5.1354222,
"band_gap": 0.0,
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"total_magnetization": 0.0003503,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:04.966000Z",
"spacegroup": 164
},
{
"id": "mp-1185886",
"created_at": "2022-09-04T14:47:03.616058Z",
"structure_string": "Mg2 Hg4\n1.0\n2.630677 4.624049 0.000000\n-2.630677 4.624049 0.000000\n0.000000 4.093366 5.678974\nMg Hg\n2 4\ndirect\n0.895482 0.104518 0.750000 Mg\n0.104518 0.895482 0.250000 Mg\n0.227551 0.437354 0.747264 Hg\n0.772449 0.562646 0.252736 Hg\n0.437354 0.227551 0.247264 Hg\n0.562646 0.772449 0.752736 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
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],
"chemical_system": "Hg-Mg",
"density": 10.227594851991588,
"density_atomic": 0.04342715902292414,
"volume": 138.1623881228967,
"volume_molar": 13.867222483563934,
"formula_full": "Mg2 Hg4",
"formula_reduced": "MgHg2",
"formula_anonymous": "AB2",
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"energy_uncorrected": -5.13578195,
"band_gap": 0.0,
"is_gap_direct": false,
"is_magnetic": false,
"total_magnetization": 1.18e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:37:55.183000Z",
"spacegroup": 15
},
{
"id": "mp-1096529",
"created_at": "2022-09-04T14:48:26.268420Z",
"structure_string": "La1 Mg2 Sc1\n1.0\n-6.113243 6.983582 9.218310\n6.113243 -6.983582 9.218310\n6.113243 6.983582 -9.218310\nLa Mg Sc\n1 2 1\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.245280 0.245280 Mg\n0.000000 0.754720 0.754720 Mg\n0.000000 0.000000 0.000000 Sc\n",
"nsites": 4,
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"elements": [
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"Mg",
"Sc"
],
"chemical_system": "La-Mg-Sc",
"density": 0.24522085288981424,
"density_atomic": 0.0025409656555490322,
"volume": 1574.2046694982623,
"volume_molar": 237.00205261919538,
"formula_full": "La1 Mg2 Sc1",
"formula_reduced": "LaMg2Sc",
"formula_anonymous": "ABC2",
"energy": -5.13609459,
"energy_per_atom": -1.2840236475,
"energy_above_hull": null,
"is_stable": null,
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"formation_energy": null,
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"energy_uncorrected": -5.13609459,
"band_gap": 0.0,
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"is_magnetic": true,
"total_magnetization": 4.4467419,
"is_theoretical": true,
"updated_at": "2021-11-28T01:39:17.407000Z",
"spacegroup": 71
},
{
"id": "mp-974816",
"created_at": "2022-09-04T14:42:52.992086Z",
"structure_string": "Rb3 Sm1\n1.0\n0.000000 5.129492 5.129492\n5.129492 0.000000 5.129492\n5.129492 5.129492 0.000000\nRb Sm\n3 1\ndirect\n0.250000 0.250000 0.250000 Rb\n0.750000 0.750000 0.750000 Rb\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Sm\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Sm"
],
"chemical_system": "Rb-Sm",
"density": 2.502291496911429,
"density_atomic": 0.014818591468317266,
"volume": 269.9311880317477,
"volume_molar": 40.6390902460303,
"formula_full": "Rb3 Sm1",
"formula_reduced": "Rb3Sm",
"formula_anonymous": "AB3",
"energy": -5.13823854,
"energy_per_atom": -1.284559635,
"energy_above_hull": null,
"is_stable": null,
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"energy_uncorrected": -5.13823854,
"band_gap": 0.0,
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"is_magnetic": true,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:35:52.559000Z",
"spacegroup": 225
},
{
"id": "mp-1058499",
"created_at": "2022-09-04T14:48:18.633967Z",
"structure_string": "Rb1 P1\n1.0\n-2.429432 2.548237 3.527276\n2.429432 -2.548237 3.527276\n2.429432 2.548237 -3.527276\nRb P\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.000000 P\n",
"nsites": 2,
"nelements": 2,
"elements": [
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"P"
],
"chemical_system": "P-Rb",
"density": 2.2136712282117834,
"density_atomic": 0.022897390774026825,
"volume": 87.34619676704203,
"volume_molar": 26.300554589089202,
"formula_full": "Rb1 P1",
"formula_reduced": "RbP",
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"energy": -5.13849561,
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"is_theoretical": true,
"updated_at": "2021-11-28T01:39:11.477000Z",
"spacegroup": 71
},
{
"id": "mp-1060787",
"created_at": "2022-09-04T14:39:06.041287Z",
"structure_string": "Rb1 P1\n1.0\n4.428720 -2.443925 0.000000\n4.428720 2.443925 0.000000\n3.080076 0.000000 4.012413\nRb P\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 P\n",
"nsites": 2,
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"elements": [
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"density": 2.2261549926559727,
"density_atomic": 0.02302651818426128,
"volume": 86.85637941419247,
"volume_molar": 26.153067136811675,
"formula_full": "Rb1 P1",
"formula_reduced": "RbP",
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"energy": -5.13876791,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:34:25.520000Z",
"spacegroup": 166
},
{
"id": "mp-1179688",
"created_at": "2022-09-04T14:47:25.861223Z",
"structure_string": "Rb1 P1\n1.0\n2.445665 4.304392 0.000000\n-2.445665 4.304392 0.000000\n0.000000 2.913287 4.145387\nRb P\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 P\n",
"nsites": 2,
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"elements": [
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"volume": 87.27781411110337,
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"formula_full": "Rb1 P1",
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"energy": -5.1390274,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:38:12.927000Z",
"spacegroup": 12
},
{
"id": "mp-1179679",
"created_at": "2022-09-04T14:46:33.934389Z",
"structure_string": "Rb1 P1\n1.0\n0.000000 3.529693 3.529693\n3.529693 0.000000 3.529693\n3.529693 3.529693 0.000000\nRb P\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 P\n",
"nsites": 2,
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"elements": [
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"volume": 87.95100301833594,
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"formula_full": "Rb1 P1",
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"energy": -5.13922684,
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"spacegroup": 225
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{
"id": "mp-977115",
"created_at": "2022-09-04T14:42:19.437999Z",
"structure_string": "Na1 Sr1 Hg2\n1.0\n0.000000 3.900283 3.900283\n3.900283 0.000000 3.900283\n3.900283 3.900283 0.000000\nNa Sr Hg\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sr\n0.250000 0.250000 0.250000 Hg\n0.750000 0.750000 0.750000 Hg\n",
"nsites": 4,
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"elements": [
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"density": 7.161802521011423,
"density_atomic": 0.03370867139640861,
"volume": 118.66382845412792,
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"formula_full": "Na1 Sr1 Hg2",
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"energy": -5.14573458,
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"energy_above_hull": null,
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"updated_at": "2021-11-28T01:35:43.998000Z",
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}
]
}