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{
"id": "mp-974062",
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"structure_string": "K1 Tm1\n1.0\n1.798313 -3.114770 0.000000\n1.798313 3.114770 0.000000\n0.000000 0.000000 7.164539\nK Tm\n1 1\ndirect\n0.666667 0.333333 0.500000 K\n0.333333 0.666667 0.000000 Tm\n",
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{
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{
"id": "mp-973627",
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"structure_string": "K3 Sr1\n1.0\n-3.173387 3.173387 6.848611\n3.173387 -3.173387 6.848611\n3.173387 3.173387 -6.848611\nK Sr\n3 1\ndirect\n0.750000 0.250000 0.500000 K\n0.250000 0.750000 0.500000 K\n0.500000 0.500000 0.000000 K\n0.000000 0.000000 0.000000 Sr\n",
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"formula_full": "K3 Sr1",
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"spacegroup": 139
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{
"id": "mp-973071",
"created_at": "2022-09-04T14:47:34.451606Z",
"structure_string": "Hg3 As1\n1.0\n-2.106954 2.106954 5.261569\n2.106954 -2.106954 5.261569\n2.106954 2.106954 -5.261569\nHg As\n3 1\ndirect\n0.750000 0.250000 0.500000 Hg\n0.250000 0.750000 0.500000 Hg\n0.500000 0.500000 0.000000 Hg\n0.000000 0.000000 0.000000 As\n",
"nsites": 4,
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"density": 12.02692253031418,
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"volume": 93.42978929213297,
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"formula_full": "Hg3 As1",
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"spacegroup": 139
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{
"id": "mp-1094937",
"created_at": "2022-09-04T14:42:19.136951Z",
"structure_string": "Mg1 Cd3\n1.0\n-1.604338 2.644506 5.285435\n1.604338 -2.644506 5.285435\n1.604338 2.644506 -5.285435\nMg Cd\n1 3\ndirect\n0.336046 0.000000 0.336046 Mg\n0.831518 0.500000 0.331518 Cd\n0.251155 0.251604 0.999551 Cd\n0.747947 0.748396 0.999551 Cd\n",
"nsites": 4,
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"elements": [
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"density": 6.693016476819881,
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"formula_full": "Mg1 Cd3",
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"updated_at": "2021-11-28T01:35:47.786000Z",
"spacegroup": 44
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{
"id": "mp-1221957",
"created_at": "2022-09-04T14:44:57.581081Z",
"structure_string": "Mg1 In1\n1.0\n1.759807 2.855322 0.000000\n-1.759807 2.855322 0.000000\n0.000000 1.888296 4.776649\nMg In\n1 1\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 In\n",
"nsites": 2,
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"elements": [
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"volume": 48.003561231245826,
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"formula_full": "Mg1 In1",
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"updated_at": "2021-11-28T01:36:46.050000Z",
"spacegroup": 12
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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",
"formula_reduced": "Na2CdHg",
"formula_anonymous": "ABC2",
"energy": -4.46907751,
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"updated_at": "2021-11-28T01:38:31.192000Z",
"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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"Na",
"Bi"
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"density": 0.30078089625787324,
"density_atomic": 0.0018680139454171107,
"volume": 2141.311637321228,
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"formula_full": "Cs1 Na2 Bi1",
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"spacegroup": 71
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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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"density": 0.44491223517680123,
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"volume": 2458.812161907364,
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"formula_full": "La1 Sn1 Hg2",
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"spacegroup": 71
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{
"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",
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"density": 1.059045436867533,
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"volume": 948.7520667767169,
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"formula_full": "Li1 Hg2 Au1",
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"updated_at": "2021-11-28T01:34:48.251000Z",
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{
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"created_at": "2022-09-04T14:43:10.127771Z",
"structure_string": "Dy1\n1.0\n-2.000643 2.000643 2.000643\n2.000643 -2.000643 2.000643\n2.000643 2.000643 -2.000643\nDy\n1\ndirect\n0.000000 0.000000 0.000000 Dy\n",
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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",
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"formula_full": "Li1 Cd2 Cu1",
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"updated_at": "2021-11-28T01:38:21.635000Z",
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}
]
}