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{
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"results": [
{
"id": "mp-975052",
"created_at": "2022-09-04T14:43:34.608349Z",
"structure_string": "Rb3 Al1\n1.0\n0.000000 4.775173 4.775173\n4.775173 0.000000 4.775173\n4.775173 4.775173 0.000000\nRb Al\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 Al\n",
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{
"id": "mp-1021292",
"created_at": "2022-09-04T14:41:32.970251Z",
"structure_string": "K2 Mg12 Cd2\n1.0\n5.367335 0.000000 0.000000\n0.000000 6.665950 0.000000\n0.000000 0.000000 11.697580\nK Mg Cd\n2 12 2\ndirect\n0.500000 0.000000 0.166845 K\n0.500000 0.500000 0.666845 K\n0.500000 0.246416 0.417208 Mg\n0.500000 0.753584 0.417208 Mg\n0.000000 0.739153 0.080562 Mg\n0.000000 0.260847 0.080562 Mg\n0.000000 0.000000 0.340429 Mg\n0.000000 0.500000 0.333220 Mg\n0.500000 0.746416 0.917208 Mg\n0.500000 0.253584 0.917208 Mg\n0.000000 0.239153 0.580562 Mg\n0.000000 0.760847 0.580562 Mg\n0.000000 0.500000 0.840429 Mg\n0.000000 0.000000 0.833220 Mg\n0.500000 0.500000 0.163962 Cd\n0.500000 0.000000 0.663962 Cd\n",
"nsites": 16,
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"density": 2.3594709223575467,
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"volume": 418.5205412001063,
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"formula_full": "K2 Mg12 Cd2",
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"formula_anonymous": "ABC6",
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"updated_at": "2021-11-28T01:35:12.339000Z",
"spacegroup": 38
},
{
"id": "mp-1038972",
"created_at": "2022-09-04T14:44:20.693325Z",
"structure_string": "Mg1 Cd1\n1.0\n4.798411 -1.667390 0.000000\n4.798411 1.667390 0.000000\n4.219013 0.000000 2.829288\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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"elements": [
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],
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"density": 5.014488632215063,
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"volume": 45.273262276596775,
"volume_molar": 13.632097904703192,
"formula_full": "Mg1 Cd1",
"formula_reduced": "MgCd",
"formula_anonymous": "AB",
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"total_magnetization": 7.6e-06,
"is_theoretical": true,
"updated_at": "2021-11-28T01:36:25.324000Z",
"spacegroup": 166
},
{
"id": "mp-1038829",
"created_at": "2022-09-04T14:41:59.490194Z",
"structure_string": "Mg1 Cd1\n1.0\n1.613275 -2.794273 0.000000\n1.613275 2.794273 0.000000\n0.000000 0.000000 4.886352\nMg Cd\n1 1\ndirect\n0.000000 0.000000 0.500000 Mg\n0.666667 0.333333 0.000000 Cd\n",
"nsites": 2,
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"elements": [
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"chemical_system": "Cd-Mg",
"density": 5.153193589138298,
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"volume": 44.05467310752584,
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"formula_full": "Mg1 Cd1",
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"total_magnetization": 3.12e-05,
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"updated_at": "2021-11-28T01:35:35.105000Z",
"spacegroup": 187
},
{
"id": "mp-1021298",
"created_at": "2022-09-04T14:43:35.864208Z",
"structure_string": "K2 Mg12 Cd2\n1.0\n5.335826 0.000000 0.000000\n0.000000 6.783258 0.000000\n0.000000 0.000000 11.592259\nK Mg Cd\n2 12 2\ndirect\n0.000000 0.500000 0.331580 K\n0.000000 0.000000 0.831580 K\n0.000000 0.253590 0.082017 Mg\n0.000000 0.746410 0.082017 Mg\n0.000000 0.500000 0.836732 Mg\n0.500000 0.265116 0.922015 Mg\n0.500000 0.734884 0.922015 Mg\n0.500000 0.500000 0.666932 Mg\n0.000000 0.753590 0.582017 Mg\n0.000000 0.246410 0.582017 Mg\n0.000000 0.000000 0.336732 Mg\n0.500000 0.765116 0.422015 Mg\n0.500000 0.234884 0.422015 Mg\n0.500000 0.000000 0.166932 Mg\n0.500000 0.500000 0.156690 Cd\n0.500000 0.000000 0.656690 Cd\n",
"nsites": 16,
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"elements": [
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],
"chemical_system": "Cd-K-Mg",
"density": 2.3535495030657194,
"density_atomic": 0.038133960490222024,
"volume": 419.57351909730386,
"volume_molar": 15.792067444828199,
"formula_full": "K2 Mg12 Cd2",
"formula_reduced": "KMg6Cd",
"formula_anonymous": "ABC6",
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"updated_at": "2021-11-28T01:36:17.006000Z",
"spacegroup": 38
},
{
"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",
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"density": 11.244092489730491,
"density_atomic": 0.03344097386914951,
"volume": 59.80687069179739,
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"formula_full": "Tl1 Hg1",
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"formula_anonymous": "AB",
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"updated_at": "2021-11-28T01:39:36.633000Z",
"spacegroup": 166
},
{
"id": "mp-1039164",
"created_at": "2022-09-04T14:46:39.165987Z",
"structure_string": "Mg2 Cd2\n1.0\n3.184373 0.000000 0.000000\n0.000000 5.242427 0.000000\n0.000000 0.000000 5.303635\nMg Cd\n2 2\ndirect\n0.000000 0.000000 0.086029 Mg\n0.500000 0.500000 0.913971 Mg\n0.500000 0.000000 0.594491 Cd\n0.000000 0.500000 0.405509 Cd\n",
"nsites": 4,
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"density": 5.1282416784940255,
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"volume": 88.53804998361684,
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"formula_full": "Mg2 Cd2",
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"energy": -5.28208382,
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"updated_at": "2021-11-28T01:37:38.358000Z",
"spacegroup": 59
},
{
"id": "mp-1023288",
"created_at": "2022-09-04T14:39:12.000116Z",
"structure_string": "Cs2 Ca2 Mg12\n1.0\n5.259137 0.000000 0.000000\n0.000000 7.104815 0.000000\n0.000000 0.000000 13.506856\nCs Ca Mg\n2 2 12\ndirect\n0.500000 0.500000 0.181888 Cs\n0.500000 0.000000 0.681888 Cs\n0.500000 0.000000 0.165913 Ca\n0.500000 0.500000 0.665913 Ca\n0.500000 0.238813 0.423396 Mg\n0.500000 0.761187 0.423396 Mg\n0.000000 0.767688 0.046881 Mg\n0.000000 0.232312 0.046881 Mg\n0.000000 0.000000 0.349542 Mg\n0.000000 0.500000 0.362099 Mg\n0.500000 0.738813 0.923396 Mg\n0.500000 0.261187 0.923396 Mg\n0.000000 0.267688 0.546881 Mg\n0.000000 0.732312 0.546881 Mg\n0.000000 0.500000 0.849542 Mg\n0.000000 0.000000 0.862099 Mg\n",
"nsites": 16,
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"elements": [
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"Ca",
"Mg"
],
"chemical_system": "Ca-Cs-Mg",
"density": 2.097945503395952,
"density_atomic": 0.031702860860685196,
"volume": 504.6863142828111,
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"formula_full": "Cs2 Ca2 Mg12",
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"spacegroup": 38
},
{
"id": "mp-1021304",
"created_at": "2022-09-04T14:40:34.837166Z",
"structure_string": "K2 Na2 Mg12\n1.0\n5.384310 0.000000 0.000000\n0.000000 6.924631 0.000000\n0.000000 0.000000 11.882348\nK Na Mg\n2 2 12\ndirect\n0.000000 0.000000 0.829305 K\n0.000000 0.500000 0.329305 K\n0.500000 0.000000 0.662360 Na\n0.500000 0.500000 0.162360 Na\n0.000000 0.743094 0.578593 Mg\n0.000000 0.256906 0.578593 Mg\n0.000000 0.000000 0.335074 Mg\n0.500000 0.769589 0.424483 Mg\n0.500000 0.230411 0.424483 Mg\n0.500000 0.000000 0.167110 Mg\n0.000000 0.243094 0.078593 Mg\n0.000000 0.756906 0.078593 Mg\n0.000000 0.500000 0.835074 Mg\n0.500000 0.269589 0.924483 Mg\n0.500000 0.730411 0.924483 Mg\n0.500000 0.500000 0.667110 Mg\n",
"nsites": 16,
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"density": 1.5586276177937222,
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"formula_full": "K2 Na2 Mg12",
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{
"id": "mp-1099272",
"created_at": "2022-09-04T14:48:08.273687Z",
"structure_string": "K1 Mg6 Zn1\n1.0\n3.051361 -6.754008 0.000000\n3.051361 6.754008 0.000000\n0.000000 0.000000 5.163672\nK Mg Zn\n1 6 1\ndirect\n0.297936 0.702064 0.500000 K\n0.317438 0.191218 0.500000 Mg\n0.808782 0.682562 0.500000 Mg\n0.176714 0.311005 0.000000 Mg\n0.688995 0.823286 0.000000 Mg\n0.701147 0.298853 0.000000 Mg\n0.132858 0.867142 0.000000 Mg\n0.876133 0.123867 0.500000 Zn\n",
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{
"id": "mp-1026854",
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"structure_string": "Cs1 K1 Mg14\n1.0\n6.754197 0.117926 0.000000\n-3.274971 5.672416 0.000000\n0.000000 0.000000 11.197677\nCs K Mg\n1 1 14\ndirect\n0.168141 0.834070 0.125000 Cs\n0.171718 0.335859 0.125000 K\n0.160983 0.330491 0.625000 Mg\n0.161441 0.830720 0.625000 Mg\n0.669023 0.334911 0.125000 Mg\n0.669082 0.333930 0.625000 Mg\n0.669023 0.834111 0.125000 Mg\n0.669082 0.835151 0.625000 Mg\n0.345167 0.176522 0.406026 Mg\n0.345167 0.176522 0.843974 Mg\n0.345167 0.668646 0.406026 Mg\n0.345167 0.668646 0.843974 Mg\n0.823342 0.161671 0.383817 Mg\n0.823342 0.161671 0.866183 Mg\n0.817077 0.658539 0.390899 Mg\n0.817077 0.658539 0.859101 Mg\n",
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"spacegroup": 38
},
{
"id": "mp-974982",
"created_at": "2022-09-04T14:44:25.312429Z",
"structure_string": "Rb3 In1\n1.0\n-3.159588 3.159588 5.878530\n3.159588 -3.159588 5.878530\n3.159588 3.159588 -5.878530\nRb In\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 In\n",
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"updated_at": "2021-11-28T01:36:38.986000Z",
"spacegroup": 139
}
]
}