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{
"id": "mp-1093823",
"created_at": "2022-09-04T14:45:27.883366Z",
"structure_string": "Ca1 Mg1 Cd2\n1.0\n-6.457505 6.705527 9.132957\n6.457505 -6.705527 9.132957\n6.457505 6.705527 -9.132957\nCa Mg Cd\n1 1 2\ndirect\n0.500000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Mg\n0.238935 0.000000 0.238935 Cd\n0.761065 0.000000 0.761065 Cd\n",
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{
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{
"id": "mp-1206317",
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"structure_string": "La2 Cd1 Sb3\n1.0\n9.870107 0.000000 0.000000\n0.000000 9.870107 0.000000\n0.000000 0.000000 42.535734\nLa Cd Sb\n2 1 3\ndirect\n0.500000 0.500000 0.243978 La\n0.500000 0.500000 0.756022 La\n0.500000 0.500000 0.500000 Cd\n0.500000 0.500000 0.691877 Sb\n0.500000 0.500000 0.308123 Sb\n0.500000 0.500000 0.000000 Sb\n",
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"density": 0.3027520052314839,
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"volume": 4143.789189118232,
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"formula_full": "La2 Cd1 Sb3",
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"formula_anonymous": "AB2C3",
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},
{
"id": "mp-1207249",
"created_at": "2022-09-04T14:42:17.630032Z",
"structure_string": "Sm3 Tl1 Te6\n1.0\n-5.539504 -9.594702 0.000000\n-7.047430 10.465304 0.000000\n0.000000 0.000000 -62.153780\nSm Tl Te\n3 1 6\ndirect\n-0.000000 0.000000 0.500000 Sm\n0.500000 0.500000 0.000000 Sm\n-0.000000 0.500000 0.000000 Sm\n-0.000000 0.000000 0.000000 Tl\n-0.000000 0.000000 0.769003 Te\n-0.000000 0.000000 0.230997 Te\n0.728287 0.728240 0.000000 Te\n0.271713 0.271760 0.000000 Te\n0.000048 0.271760 -0.000000 Te\n-0.000048 0.728240 -0.000000 Te\n",
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"volume": 7805.929533295315,
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"formula_full": "Sm3 Tl1 Te6",
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"formula_anonymous": "AB3C6",
"energy": -26.88448616,
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"updated_at": "2021-11-28T01:35:43.097000Z",
"spacegroup": 65
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{
"id": "mp-1180106",
"created_at": "2022-09-04T14:45:36.222085Z",
"structure_string": "Na1 S1\n1.0\n5.713813 5.324788 0.000000\n-5.713813 5.324788 0.000000\n0.000000 1.730208 4.974654\nNa S\n1 1\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 S\n",
"nsites": 2,
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"elements": [
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"volume": 302.7061328303233,
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"updated_at": "2021-11-28T01:37:01.206000Z",
"spacegroup": 12
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{
"id": "mp-1093877",
"created_at": "2022-09-04T14:47:20.873158Z",
"structure_string": "Ca2 Cd1 Ge1\n1.0\n-6.159684 6.473131 9.147462\n6.159684 -6.473131 9.147462\n6.159684 6.473131 -9.147462\nCa Cd Ge\n2 1 1\ndirect\n0.000000 0.227265 0.227265 Ca\n0.000000 0.772735 0.772735 Ca\n0.000000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Ge\n",
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"Cd",
"Ge"
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"chemical_system": "Ca-Cd-Ge",
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"volume": 1458.9265720665003,
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"formula_full": "Ca2 Cd1 Ge1",
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"formula_anonymous": "ABC2",
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"updated_at": "2021-11-28T01:38:03.979000Z",
"spacegroup": 71
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{
"id": "mp-1096271",
"created_at": "2022-09-04T14:46:36.528296Z",
"structure_string": "Li1 Sc2 In1\n1.0\n-5.736438 6.121823 8.296746\n5.736438 -6.121823 8.296746\n5.736438 6.121823 -8.296746\nLi Sc In\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.259373 0.000000 0.259373 Sc\n0.740627 0.000000 0.740627 Sc\n0.500000 0.000000 0.500000 In\n",
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"density": 0.30159159854665885,
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"volume": 1165.4425196364832,
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"formula_full": "Li1 Sc2 In1",
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"updated_at": "2021-11-28T01:37:39.733000Z",
"spacegroup": 71
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{
"id": "mp-1096318",
"created_at": "2022-09-04T14:46:11.939259Z",
"structure_string": "Li1 Sc1 Zn2\n1.0\n-5.468998 5.654104 8.137668\n5.468998 -5.654104 8.137668\n5.468998 5.654104 -8.137668\nLi Sc Zn\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Sc\n0.000000 0.242259 0.242259 Zn\n0.000000 0.757741 0.757741 Zn\n",
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"formula_full": "Li1 Sc1 Zn2",
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"updated_at": "2021-11-28T01:37:23.815000Z",
"spacegroup": 71
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{
"id": "mp-1093910",
"created_at": "2022-09-04T14:41:55.143120Z",
"structure_string": "Sc2 Zn1 Ni1\n1.0\n-5.158670 6.324736 9.051557\n5.158670 -6.324736 9.051557\n5.158670 6.324736 -9.051557\nSc Zn Ni\n2 1 1\ndirect\n0.500000 0.711802 0.211802 Sc\n0.500000 0.288198 0.788198 Sc\n0.500000 0.000000 0.500000 Zn\n0.500000 0.500000 0.000000 Ni\n",
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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",
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{
"id": "mp-1209731",
"created_at": "2022-09-04T14:47:12.567658Z",
"structure_string": "Tl3 Bi1 S6\n1.0\n6.326485 -8.134119 0.000000\n6.326485 8.134119 0.000000\n0.000000 0.000000 54.453852\nTl Bi S\n3 1 6\ndirect\n0.000000 0.000000 0.500000 Tl\n0.500000 0.000000 0.000000 Tl\n0.000000 0.500000 0.000000 Tl\n0.000000 0.000000 0.000000 Bi\n0.000000 0.000000 0.250225 S\n0.000000 0.000000 0.749775 S\n0.256936 0.011334 0.000000 S\n0.743064 0.988666 0.000000 S\n0.011334 0.256936 0.000000 S\n0.988666 0.743064 0.000000 S\n",
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{
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]
}