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{
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{
"id": "mp-11466",
"created_at": "2022-09-04T14:43:23.361041Z",
"structure_string": "Na1 Hg2\n1.0\n2.601532 -4.505986 0.000000\n2.601532 4.505986 0.000000\n0.000000 0.000000 3.348606\nNa Hg\n1 2\ndirect\n0.000000 0.000000 0.000000 Na\n0.666667 0.333333 0.500000 Hg\n0.333333 0.666667 0.500000 Hg\n",
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{
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{
"id": "mp-1095971",
"created_at": "2022-09-04T14:39:48.368982Z",
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"nsites": 4,
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"volume": 1558.6041277804834,
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"formula_full": "Sr2 Mg1 In1",
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"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:34:44.036000Z",
"spacegroup": 71
},
{
"id": "mp-1216519",
"created_at": "2022-09-04T14:48:26.470862Z",
"structure_string": "Tl1 Hg1\n1.0\n5.872553 -1.727203 0.000000\n5.872553 1.727203 0.000000\n5.364557 0.000000 2.948158\nTl Hg\n1 1\ndirect\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 2,
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"elements": [
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],
"chemical_system": "Hg-Tl",
"density": 11.244092489730491,
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"volume": 59.80687069179739,
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"formula_full": "Tl1 Hg1",
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"updated_at": "2021-11-28T01:39:36.633000Z",
"spacegroup": 166
},
{
"id": "mp-1096599",
"created_at": "2022-09-04T14:41:15.920361Z",
"structure_string": "Na1 Cd2 In1\n1.0\n-5.977618 6.294192 8.963605\n5.977618 -6.294192 8.963605\n5.977618 6.294192 -8.963605\nNa Cd In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.252715 0.252715 Cd\n0.000000 0.747285 0.747285 Cd\n0.000000 0.500000 0.500000 In\n",
"nsites": 4,
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"elements": [
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],
"chemical_system": "Cd-In-Na",
"density": 0.446376893027602,
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"volume": 1348.9965721956617,
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"formula_full": "Na1 Cd2 In1",
"formula_reduced": "NaCd2In",
"formula_anonymous": "ABC2",
"energy": -2.65177555,
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"updated_at": "2021-11-28T01:35:15.247000Z",
"spacegroup": 71
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{
"id": "mp-1093639",
"created_at": "2022-09-04T14:40:31.353718Z",
"structure_string": "La1 Mg2 Cd1\n1.0\n-6.348615 7.491552 10.604657\n6.348615 -7.491552 10.604657\n6.348615 7.491552 -10.604657\nLa Mg Cd\n1 2 1\ndirect\n0.000000 0.500000 0.500000 La\n0.000000 0.239391 0.239391 Mg\n0.000000 0.760609 0.760609 Mg\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 4,
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"elements": [
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],
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"density": 0.2468632753388417,
"density_atomic": 0.001982679812260511,
"volume": 2017.471492504624,
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"formula_full": "La1 Mg2 Cd1",
"formula_reduced": "LaMg2Cd",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:05.969000Z",
"spacegroup": 71
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{
"id": "mp-1093922",
"created_at": "2022-09-04T14:44:21.931745Z",
"structure_string": "Cs1 K1 Na2\n1.0\n-7.476020 8.006771 10.619343\n7.476020 -8.006771 10.619343\n7.476020 8.006771 -10.619343\nCs K Na\n1 1 2\ndirect\n0.500000 0.000000 0.500000 Cs\n0.000000 0.000000 0.000000 K\n0.761787 0.000000 0.761787 Na\n0.238213 0.000000 0.238213 Na\n",
"nsites": 4,
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"elements": [
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"density": 0.14235961325915328,
"density_atomic": 0.0015731657744461251,
"volume": 2542.6436711085366,
"volume_molar": 382.8039522484688,
"formula_full": "Cs1 K1 Na2",
"formula_reduced": "CsKNa2",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:36:41.051000Z",
"spacegroup": 71
},
{
"id": "mp-1097246",
"created_at": "2022-09-04T14:41:21.244488Z",
"structure_string": "Sr2 Zn1 In1\n1.0\n-6.628002 6.661720 9.109885\n6.628002 -6.661720 9.109885\n6.628002 6.661720 -9.109885\nSr Zn In\n2 1 1\ndirect\n0.258129 0.000000 0.258129 Sr\n0.741871 0.000000 0.741871 Sr\n0.000000 0.000000 0.000000 Zn\n0.500000 0.000000 0.500000 In\n",
"nsites": 4,
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"In"
],
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"density": 0.3668651808300881,
"density_atomic": 0.0024860971732004783,
"volume": 1608.9475677455512,
"volume_molar": 242.2327182105836,
"formula_full": "Sr2 Zn1 In1",
"formula_reduced": "Sr2ZnIn",
"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:35:28.117000Z",
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{
"id": "mp-1097486",
"created_at": "2022-09-04T14:43:03.625121Z",
"structure_string": "Sr1 Li2 Ca1\n1.0\n-6.509777 7.112595 9.203910\n6.509777 -7.112595 9.203910\n6.509777 7.112595 -9.203910\nSr Li Ca\n1 2 1\ndirect\n0.500000 0.000000 0.500000 Sr\n0.244126 0.000000 0.244126 Li\n0.755874 0.000000 0.755874 Li\n0.000000 0.000000 0.000000 Ca\n",
"nsites": 4,
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"elements": [
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"Li",
"Ca"
],
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"density": 0.13791911418705752,
"density_atomic": 0.0023465696268286478,
"volume": 1704.6159441712102,
"volume_molar": 256.63592893848323,
"formula_full": "Sr1 Li2 Ca1",
"formula_reduced": "SrLi2Ca",
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"energy": -2.67700221,
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"updated_at": "2021-11-28T01:36:07.907000Z",
"spacegroup": 71
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{
"id": "mp-1097520",
"created_at": "2022-09-04T14:47:17.645725Z",
"structure_string": "Ba1 Li2 Ca1\n1.0\n-6.840243 7.282377 9.661468\n6.840243 -7.282377 9.661468\n6.840243 7.282377 -9.661468\nBa Li Ca\n1 2 1\ndirect\n0.500000 0.000000 0.500000 Ba\n0.236024 0.000000 0.236024 Li\n0.763976 0.000000 0.763976 Li\n0.000000 0.000000 0.000000 Ca\n",
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"formula_full": "Ba1 Li2 Ca1",
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{
"id": "mp-1097334",
"created_at": "2022-09-04T14:47:15.953287Z",
"structure_string": "K1 Rb1 Na2\n1.0\n-7.645250 7.802594 10.817162\n7.645250 -7.802594 10.817162\n7.645250 7.802594 -10.817162\nK Rb Na\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.000000 0.500000 Rb\n0.248797 0.000000 0.248797 Na\n0.751203 0.000000 0.751203 Na\n",
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"volume": 2581.0952169947304,
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"formula_full": "K1 Rb1 Na2",
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"spacegroup": 71
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{
"id": "mp-1038814",
"created_at": "2022-09-04T14:39:39.318022Z",
"structure_string": "Mg1 Cd1\n1.0\n3.505626 0.000000 0.000000\n0.000000 3.505626 0.000000\n0.000000 0.000000 3.505626\nMg Cd\n1 1\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Cd\n",
"nsites": 2,
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"updated_at": "2021-11-28T01:34:40.306000Z",
"spacegroup": 221
}
]
}