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"results": [
{
"id": "mp-1097187",
"created_at": "2022-09-04T14:40:39.606950Z",
"structure_string": "Li2 Mg1 Zn1\n1.0\n-5.650745 5.804599 7.990925\n5.650745 -5.804599 7.990925\n5.650745 5.804599 -7.990925\nLi Mg Zn\n2 1 1\ndirect\n0.261001 0.000000 0.261001 Li\n0.738999 0.000000 0.738999 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 0.000000 0.500000 Zn\n",
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{
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"structure_string": "Y2 Ti1 Si2\n1.0\n9.356924 0.000000 0.000000\n0.000000 9.356924 0.000000\n0.000000 0.000000 32.650477\nY Ti Si\n2 1 2\ndirect\n0.500000 0.500000 0.656273 Y\n0.500000 0.500000 0.343727 Y\n0.500000 0.500000 0.000000 Ti\n0.500000 0.500000 0.262233 Si\n0.500000 0.500000 0.737767 Si\n",
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"spacegroup": 123
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{
"id": "mp-1190655",
"created_at": "2022-09-04T14:39:07.942800Z",
"structure_string": "Li4 B4 H16\n1.0\n7.484810 0.000000 0.000000\n0.000000 8.685812 0.000000\n0.000000 1.042278 13.773539\nLi B H\n4 4 16\ndirect\n0.514331 0.743639 0.842494 Li\n0.514331 0.756361 0.157506 Li\n0.485669 0.256361 0.157506 Li\n0.485669 0.243639 0.842494 Li\n0.432088 0.504859 0.154085 B\n0.432088 0.995141 0.845915 B\n0.567912 0.495141 0.845915 B\n0.567912 0.004859 0.154085 B\n0.353650 0.462487 0.084099 H\n0.353650 0.037513 0.915901 H\n0.646350 0.537513 0.915901 H\n0.646350 0.962487 0.084099 H\n0.587704 0.547566 0.141817 H\n0.587704 0.952434 0.858183 H\n0.412296 0.452434 0.858183 H\n0.412296 0.047566 0.141817 H\n0.474501 0.211293 0.343863 H\n0.474501 0.288707 0.656137 H\n0.525499 0.788707 0.656137 H\n0.525499 0.711293 0.343863 H\n0.391937 0.451853 0.235147 H\n0.391937 0.048147 0.764853 H\n0.608063 0.548147 0.764853 H\n0.608063 0.951853 0.235147 H\n",
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"density_atomic": 0.02680244992151538,
"volume": 895.4405313797175,
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"formula_full": "Li4 B4 H16",
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"updated_at": "2021-11-28T01:34:26.107000Z",
"spacegroup": 13
},
{
"id": "mp-1206633",
"created_at": "2022-09-04T14:40:15.935239Z",
"structure_string": "Co1 Cl6\n1.0\n5.030051 -6.425303 0.000000\n5.030051 6.425303 0.000000\n0.000000 0.000000 43.411698\nCo Cl\n1 6\ndirect\n0.000000 0.000000 0.000000 Co\n0.000000 0.000000 0.249980 Cl\n0.000000 0.000000 0.750020 Cl\n0.267684 0.035593 0.000000 Cl\n0.732316 0.964407 0.000000 Cl\n0.035593 0.267684 0.000000 Cl\n0.964407 0.732316 0.000000 Cl\n",
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"elements": [
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"density": 0.16075257837314846,
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"volume": 2806.0975839465764,
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"formula_full": "Co1 Cl6",
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"energy": -20.16140489,
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{
"id": "mp-1097089",
"created_at": "2022-09-04T14:44:19.043024Z",
"structure_string": "Cs1 Rb1 Na2\n1.0\n-7.672120 8.188441 10.868048\n7.672120 -8.188441 10.868048\n7.672120 8.188441 -10.868048\nCs Rb Na\n1 1 2\ndirect\n0.500000 0.000000 0.500000 Cs\n0.000000 0.000000 0.000000 Rb\n0.753124 0.000000 0.753124 Na\n0.246876 0.000000 0.246876 Na\n",
"nsites": 4,
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"elements": [
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"density_atomic": 0.0014646432044920594,
"volume": 2731.0405617777787,
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"formula_full": "Cs1 Rb1 Na2",
"formula_reduced": "CsRbNa2",
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"updated_at": "2021-11-28T01:36:33.616000Z",
"spacegroup": 71
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{
"id": "mp-1207368",
"created_at": "2022-09-04T14:41:50.995056Z",
"structure_string": "Sm2 Sb3 Pd1\n1.0\n15.093568 -0.000000 0.000000\n-0.000000 15.093568 0.000000\n-0.000000 0.000000 35.471372\nSm Sb Pd\n2 3 1\ndirect\n0.500000 0.500000 0.236864 Sm\n0.500000 0.500000 0.763136 Sm\n0.500000 0.500000 0.687339 Sb\n0.500000 0.500000 0.312661 Sb\n0.500000 0.500000 -0.000000 Sb\n0.500000 0.500000 0.500000 Pd\n",
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"Pd"
],
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"density": 0.15872333844385297,
"density_atomic": 0.0007424879881434904,
"volume": 8080.9388108787325,
"volume_molar": 811.0758498676457,
"formula_full": "Sm2 Sb3 Pd1",
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"formula_anonymous": "AB2C3",
"energy": -13.11962964,
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"updated_at": "2021-11-28T01:35:27.039000Z",
"spacegroup": 123
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{
"id": "mp-1096762",
"created_at": "2022-09-04T14:46:54.153108Z",
"structure_string": "Sr1 Li2 Si1\n1.0\n-6.105497 6.336943 8.868855\n6.105497 -6.336943 8.868855\n6.105497 6.336943 -8.868855\nSr Li Si\n1 2 1\ndirect\n0.000000 0.500000 0.500000 Sr\n0.000000 0.200532 0.200532 Li\n0.000000 0.799468 0.799468 Li\n0.000000 0.000000 0.000000 Si\n",
"nsites": 4,
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"elements": [
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"Li",
"Si"
],
"chemical_system": "Li-Si-Sr",
"density": 0.15677753805597824,
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"volume": 1372.5506151027485,
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"formula_full": "Sr1 Li2 Si1",
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"formula_anonymous": "ABC2",
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"spacegroup": 71
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{
"id": "mp-1097519",
"created_at": "2022-09-04T14:41:58.677761Z",
"structure_string": "Na1 Sr2 Li1\n1.0\n-7.203664 7.390764 10.213560\n7.203664 -7.390764 10.213560\n7.203664 7.390764 -10.213560\nNa Sr Li\n1 2 1\ndirect\n0.500000 0.000000 0.500000 Na\n0.755947 0.000000 0.755947 Sr\n0.244053 0.000000 0.244053 Sr\n0.000000 0.000000 0.000000 Li\n",
"nsites": 4,
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"volume": 2175.103455908813,
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"formula_full": "Na1 Sr2 Li1",
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{
"id": "mp-1097331",
"created_at": "2022-09-04T14:41:50.025274Z",
"structure_string": "Li2 Ca1 Ga1\n1.0\n-6.121594 6.198088 8.640306\n6.121594 -6.198088 8.640306\n6.121594 6.198088 -8.640306\nLi Ca Ga\n2 1 1\ndirect\n0.718208 0.000000 0.718208 Li\n0.281792 0.000000 0.281792 Li\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.500000 Ga\n",
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"volume": 1311.3281236983746,
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"formula_full": "Li2 Ca1 Ga1",
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{
"id": "mp-1096333",
"created_at": "2022-09-04T14:39:21.002481Z",
"structure_string": "Ba1 Na2 Ca1\n1.0\n-7.450149 7.615814 10.547823\n7.450149 -7.615814 10.547823\n7.450149 7.615814 -10.547823\nBa Na Ca\n1 2 1\ndirect\n0.500000 0.000000 0.500000 Ba\n0.238419 0.000000 0.238419 Na\n0.761581 0.000000 0.761581 Na\n0.000000 0.000000 0.000000 Ca\n",
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{
"id": "mp-973783",
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"structure_string": "H4\n1.0\n2.399335 -2.420787 0.000000\n2.399335 2.420787 0.000000\n0.000000 0.000000 3.757380\nH\n4\ndirect\n0.052507 0.052507 0.073940 H\n0.552507 0.552507 0.426060 H\n0.447493 0.447493 0.573940 H\n0.947493 0.947493 0.926060 H\n",
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"updated_at": "2021-11-28T01:34:49.223000Z",
"spacegroup": 64
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{
"id": "mp-1093633",
"created_at": "2022-09-04T14:48:19.026876Z",
"structure_string": "K1 Na2 As1\n1.0\n-6.629914 6.744021 9.702408\n6.629914 -6.744021 9.702408\n6.629914 6.744021 -9.702408\nK Na As\n1 2 1\ndirect\n0.000000 0.000000 0.000000 K\n0.000000 0.292662 0.292662 Na\n0.000000 0.707338 0.707338 Na\n0.000000 0.500000 0.500000 As\n",
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"density": 0.15310917716948275,
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"volume": 1735.2671033484073,
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"formula_full": "K1 Na2 As1",
"formula_reduced": "KNa2As",
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"updated_at": "2021-11-28T01:38:49.189000Z",
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}
]
}