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{
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"results": [
{
"id": "mp-1184861",
"created_at": "2022-09-04T14:47:32.646504Z",
"structure_string": "K3 Be1\n1.0\n0.000000 4.483526 4.483526\n4.483526 0.000000 4.483526\n4.483526 4.483526 0.000000\nK Be\n3 1\ndirect\n0.250000 0.250000 0.250000 K\n0.750000 0.750000 0.750000 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 Be\n",
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{
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{
"id": "mp-570752",
"created_at": "2022-09-04T14:39:08.729714Z",
"structure_string": "H2\n1.0\n2.565599 -4.443747 0.000000\n2.565599 4.443747 0.000000\n0.000000 0.000000 3.811892\nH\n2\ndirect\n0.333333 0.666667 0.250000 H\n0.666667 0.333333 0.750000 H\n",
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"is_theoretical": false,
"updated_at": "2021-11-28T01:34:30.676000Z",
"spacegroup": 194
},
{
"id": "mp-569954",
"created_at": "2022-09-04T14:47:10.263544Z",
"structure_string": "Sr2 Cd22\n1.0\n-6.090683 6.090683 3.920792\n6.090683 -6.090683 3.920792\n6.090683 6.090683 -3.920792\nSr Cd\n2 22\ndirect\n0.750000 0.250000 0.500000 Sr\n0.500000 0.500000 0.000000 Sr\n0.995489 0.320358 0.915642 Cd\n0.125000 0.875000 0.750000 Cd\n0.679642 0.595284 0.675131 Cd\n0.404716 0.320358 0.324869 Cd\n0.679642 0.004511 0.084358 Cd\n0.845284 0.429642 0.175131 Cd\n0.404716 0.079848 0.084358 Cd\n0.000000 0.000000 0.000000 Cd\n0.845284 0.670152 0.415642 Cd\n0.250000 0.750000 0.500000 Cd\n0.329848 0.745489 0.175131 Cd\n0.125000 0.875000 0.250000 Cd\n0.254511 0.429642 0.584358 Cd\n0.570358 0.745489 0.415642 Cd\n0.995489 0.079848 0.675131 Cd\n0.920152 0.004511 0.324869 Cd\n0.329848 0.154716 0.584358 Cd\n0.254511 0.670152 0.824869 Cd\n0.570358 0.154716 0.824869 Cd\n0.920152 0.595284 0.915642 Cd\n0.625000 0.875000 0.750000 Cd\n0.125000 0.375000 0.250000 Cd\n",
"nsites": 24,
"nelements": 2,
"elements": [
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"chemical_system": "Cd-Sr",
"density": 7.558707478258614,
"density_atomic": 0.04125204226450381,
"volume": 581.7893777504273,
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"formula_full": "Sr2 Cd22",
"formula_reduced": "SrCd11",
"formula_anonymous": "AB11",
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"updated_at": "2021-11-28T01:37:53.682000Z",
"spacegroup": 141
},
{
"id": "mp-1093583",
"created_at": "2022-09-04T14:48:12.060693Z",
"structure_string": "Na2 Hg1 Bi1\n1.0\n-6.194895 6.387509 9.005080\n6.194895 -6.387509 9.005080\n6.194895 6.387509 -9.005080\nNa Hg Bi\n2 1 1\ndirect\n0.000000 0.259856 0.259856 Na\n0.000000 0.740144 0.740144 Na\n0.000000 0.000000 0.000000 Hg\n0.000000 0.500000 0.500000 Bi\n",
"nsites": 4,
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"elements": [
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"Bi"
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"chemical_system": "Bi-Hg-Na",
"density": 0.5307280583351984,
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"volume": 1425.322173730532,
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"formula_full": "Na2 Hg1 Bi1",
"formula_reduced": "Na2HgBi",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:38:41.495000Z",
"spacegroup": 71
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{
"id": "mp-1096051",
"created_at": "2022-09-04T14:48:02.824282Z",
"structure_string": "Li1 Cd2 Cu1\n1.0\n-5.376745 5.456442 7.709052\n5.376745 -5.456442 7.709052\n5.376745 5.456442 -7.709052\nLi Cd Cu\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.261587 0.261587 Cd\n0.000000 0.738413 0.738413 Cd\n0.000000 0.500000 0.500000 Cu\n",
"nsites": 4,
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"elements": [
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"Cd",
"Cu"
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"density": 0.5420456093005805,
"density_atomic": 0.0044215041988915,
"volume": 904.6695016150445,
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"formula_full": "Li1 Cd2 Cu1",
"formula_reduced": "LiCd2Cu",
"formula_anonymous": "ABC2",
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"is_theoretical": true,
"updated_at": "2021-11-28T01:38:21.635000Z",
"spacegroup": 71
},
{
"id": "mp-1097526",
"created_at": "2022-09-04T14:40:11.721314Z",
"structure_string": "Li1 Hg2 Au1\n1.0\n-5.401849 5.578494 7.871062\n5.401849 -5.578494 7.871062\n5.401849 5.578494 -7.871062\nLi Hg Au\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.244469 0.244469 Hg\n0.000000 0.755531 0.755531 Hg\n0.000000 0.500000 0.500000 Au\n",
"nsites": 4,
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"elements": [
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"Au"
],
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"density": 1.059045436867533,
"density_atomic": 0.004216064596928437,
"volume": 948.7520667767169,
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"formula_full": "Li1 Hg2 Au1",
"formula_reduced": "LiHg2Au",
"formula_anonymous": "ABC2",
"energy": -4.46277878,
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"updated_at": "2021-11-28T01:34:48.251000Z",
"spacegroup": 71
},
{
"id": "mp-973599",
"created_at": "2022-09-04T14:47:24.187370Z",
"structure_string": "Hg6 As2\n1.0\n3.061227 -5.302200 0.000000\n3.061227 5.302200 0.000000\n0.000000 0.000000 5.983545\nHg As\n6 2\ndirect\n0.166865 0.333729 0.250000 Hg\n0.666271 0.833135 0.250000 Hg\n0.166865 0.833135 0.250000 Hg\n0.833135 0.666271 0.750000 Hg\n0.333729 0.166865 0.750000 Hg\n0.833135 0.166865 0.750000 Hg\n0.333333 0.666667 0.750000 As\n0.666667 0.333333 0.250000 As\n",
"nsites": 8,
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"elements": [
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"As"
],
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"density": 11.569902012946214,
"density_atomic": 0.04118601651059232,
"volume": 194.24068355682178,
"volume_molar": 14.621809221222478,
"formula_full": "Hg6 As2",
"formula_reduced": "Hg3As",
"formula_anonymous": "AB3",
"energy": -8.92642559,
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"updated_at": "2021-11-28T01:38:07.215000Z",
"spacegroup": 194
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{
"id": "mp-1095945",
"created_at": "2022-09-04T14:47:13.632266Z",
"structure_string": "La1 Sn1 Hg2\n1.0\n-6.007849 9.398394 10.886611\n6.007849 -9.398394 10.886611\n6.007849 9.398394 -10.886611\nLa Sn Hg\n1 1 2\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Sn\n0.000000 0.237699 0.237699 Hg\n0.000000 0.762301 0.762301 Hg\n",
"nsites": 4,
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"elements": [
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"density": 0.44491223517680123,
"density_atomic": 0.0016268017793181471,
"volume": 2458.812161907364,
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"formula_full": "La1 Sn1 Hg2",
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"updated_at": "2021-11-28T01:38:00.152000Z",
"spacegroup": 71
},
{
"id": "mp-634659",
"created_at": "2022-09-04T14:39:44.232237Z",
"structure_string": "H1\n1.0\n0.000000 2.714276 2.714276\n2.714276 0.000000 2.714276\n2.714276 2.714276 0.000000\nH\n1\ndirect\n0.000000 0.000000 0.000000 H\n",
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"updated_at": "2021-11-28T01:34:41.544000Z",
"spacegroup": 225
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{
"id": "mp-1096426",
"created_at": "2022-09-04T14:43:21.068586Z",
"structure_string": "Cs1 Na2 Bi1\n1.0\n-7.161577 7.312419 10.222336\n7.161577 -7.312419 10.222336\n7.161577 7.312419 -10.222336\nCs Na Bi\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.000000 0.285966 0.285966 Na\n0.000000 0.714034 0.714034 Na\n0.000000 0.500000 0.500000 Bi\n",
"nsites": 4,
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"volume": 2141.311637321228,
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"formula_full": "Cs1 Na2 Bi1",
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"energy": -4.46452965,
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"updated_at": "2021-11-28T01:36:10.932000Z",
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{
"id": "mp-973056",
"created_at": "2022-09-04T14:48:14.060466Z",
"structure_string": "Na2 Cd1 Hg1\n1.0\n0.000000 3.756446 3.756446\n3.756446 0.000000 3.756446\n3.756446 3.756446 0.000000\nNa Cd Hg\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Na\n0.750000 0.750000 0.750000 Na\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 4,
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"density": 5.622876647666106,
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"volume": 106.0135666812844,
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"formula_full": "Na2 Cd1 Hg1",
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"total_magnetization": 1.18e-05,
"is_theoretical": true,
"updated_at": "2021-11-28T01:38:31.192000Z",
"spacegroup": 225
}
]
}