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{
"id": "mp-1228963",
"created_at": "2022-09-04T14:48:15.065819Z",
"structure_string": "Al1 Ag1 Sn1 Se4\n1.0\n-3.028106 3.028106 5.406207\n3.028106 -3.028106 5.406207\n3.028106 3.028106 -5.406207\nAl Ag Sn Se\n1 1 1 4\ndirect\n0.500000 0.500000 0.000000 Al\n0.750000 0.250000 0.500000 Ag\n0.250000 0.750000 0.500000 Sn\n0.862673 0.367191 0.014159 Se\n0.353032 0.848514 0.985841 Se\n0.632809 0.646968 0.495482 Se\n0.151486 0.137327 0.504518 Se\n",
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{
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{
"id": "mp-1224941",
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"structure_string": "Fe1 Mo2\n1.0\n0.000000 2.144119 6.441864\n1.580612 0.000000 6.441864\n1.580612 2.144119 0.000000\nFe Mo\n1 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.338631 0.338631 0.661369 Mo\n0.661369 0.661369 0.338631 Mo\n",
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"formula_full": "Fe1 Mo2",
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"spacegroup": 69
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{
"id": "mp-1102396",
"created_at": "2022-09-04T14:47:10.791501Z",
"structure_string": "Ba8 In4\n1.0\n6.005287 0.000000 0.000000\n0.000000 8.220918 0.000000\n0.000000 0.000000 11.114259\nBa In\n8 4\ndirect\n0.250000 0.023088 0.693867 Ba\n0.250000 0.523088 0.806133 Ba\n0.750000 0.976912 0.306133 Ba\n0.750000 0.476912 0.193867 Ba\n0.250000 0.672843 0.426204 Ba\n0.250000 0.172843 0.073796 Ba\n0.750000 0.327157 0.573796 Ba\n0.750000 0.827157 0.926204 Ba\n0.250000 0.231059 0.395468 In\n0.250000 0.731059 0.104532 In\n0.750000 0.768941 0.604532 In\n0.750000 0.268941 0.895468 In\n",
"nsites": 12,
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"formula_full": "Ba8 In4",
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"spacegroup": 62
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{
"id": "mp-1087545",
"created_at": "2022-09-04T14:46:24.174782Z",
"structure_string": "Zn3 Cr1 Te4\n1.0\n6.204317 0.000000 0.000000\n0.000000 6.204317 0.000000\n0.000000 0.000000 6.204317\nZn Cr Te\n3 1 4\ndirect\n0.500000 0.500000 0.000000 Zn\n0.500000 0.000000 0.500000 Zn\n0.000000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Cr\n0.749296 0.749296 0.250704 Te\n0.749296 0.250704 0.749296 Te\n0.250704 0.749296 0.749296 Te\n0.250704 0.250704 0.250704 Te\n",
"nsites": 8,
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"elements": [
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"density": 5.274644838818797,
"density_atomic": 0.03349716473368817,
"volume": 238.82618315914908,
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"formula_full": "Zn3 Cr1 Te4",
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"updated_at": "2021-11-28T01:37:30.188000Z",
"spacegroup": 215
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{
"id": "mp-1206991",
"created_at": "2022-09-04T14:44:30.259081Z",
"structure_string": "Ga1 Ni3 C1\n1.0\n3.775591 0.000000 0.000000\n0.000000 3.775591 0.000000\n0.000000 0.000000 3.775591\nGa Ni C\n1 3 1\ndirect\n0.500000 0.500000 0.500000 Ga\n0.500000 0.000000 0.000000 Ni\n0.000000 0.500000 0.000000 Ni\n0.000000 0.000000 0.500000 Ni\n0.000000 0.000000 0.000000 C\n",
"nsites": 5,
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"density": 7.95427496167457,
"density_atomic": 0.09289988530389884,
"volume": 53.82137968893875,
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"formula_full": "Ga1 Ni3 C1",
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"updated_at": "2021-11-28T01:36:39.641000Z",
"spacegroup": 221
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{
"id": "mp-1026615",
"created_at": "2022-09-04T14:40:11.544224Z",
"structure_string": "Rb1 Mg14 Nb1\n1.0\n6.560644 0.000000 -0.000000\n-3.280322 5.681684 0.000000\n0.000000 -0.000000 10.363225\nRb Mg Nb\n1 14 1\ndirect\n0.166667 0.333333 0.125000 Rb\n0.175866 0.837932 0.125000 Mg\n0.162741 0.831370 0.625000 Mg\n0.662068 0.324134 0.125000 Mg\n0.668630 0.337259 0.625000 Mg\n0.662068 0.837932 0.125000 Mg\n0.668630 0.831370 0.625000 Mg\n0.334806 0.165194 0.395404 Mg\n0.334806 0.165194 0.854596 Mg\n0.334806 0.669614 0.395404 Mg\n0.334806 0.669614 0.854596 Mg\n0.830386 0.165194 0.395404 Mg\n0.830386 0.165194 0.854596 Mg\n0.833333 0.666667 0.370027 Mg\n0.833333 0.666667 0.879973 Mg\n0.166667 0.333333 0.625000 Nb\n",
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"elements": [
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"density": 2.2294622894339793,
"density_atomic": 0.041419181006054885,
"volume": 386.294456127972,
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"formula_full": "Rb1 Mg14 Nb1",
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{
"id": "mp-1245873",
"created_at": "2022-09-04T14:47:17.720395Z",
"structure_string": "Ge1 C1 N2\n1.0\n3.587605 -0.000017 -0.000023\n1.793780 5.029591 -0.037128\n-0.000085 14.471516 2.933631\nGe C N\n1 1 2\ndirect\n0.000000 0.999855 0.000039 Ge\n-0.000001 0.000020 0.499986 C\n-0.000000 0.000019 0.416041 N\n0.000000 0.000007 0.583934 N\n",
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"density": 3.4100622098468585,
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"formula_full": "Ge1 C1 N2",
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{
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"structure_string": "Np1 Si3\n1.0\n4.003455 0.000000 0.000000\n0.000000 4.003455 0.000000\n0.000000 0.000000 4.003455\nNp Si\n1 3\ndirect\n0.000000 0.000000 0.000000 Np\n0.500000 0.000000 0.500000 Si\n0.000000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 Si\n",
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"volume": 64.16598328554241,
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"formula_full": "Np1 Si3",
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{
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"structure_string": "K4 Zn2 Te4\n1.0\n-3.524231 3.685901 7.098003\n3.524231 -3.685901 7.098003\n3.524231 3.685901 -7.098003\nK Zn Te\n4 2 4\ndirect\n0.176362 0.859448 0.316914 K\n0.823638 0.140552 0.683086 K\n0.457466 0.640552 0.816914 K\n0.542534 0.359448 0.183086 K\n0.000000 0.250000 0.250000 Zn\n0.000000 0.750000 0.750000 Zn\n0.913469 0.606768 0.306702 Te\n0.086531 0.393232 0.693298 Te\n0.699934 0.893232 0.806702 Te\n0.300066 0.106768 0.193298 Te\n",
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{
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"created_at": "2022-09-04T14:39:19.453850Z",
"structure_string": "Ca1 Ge2 Rh2\n1.0\n-2.093655 2.093655 5.250675\n2.093655 -2.093655 5.250675\n2.093655 2.093655 -5.250675\nCa Ge Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ca\n0.373904 0.373904 0.000000 Ge\n0.626096 0.626096 0.000000 Ge\n0.250000 0.750000 0.500000 Rh\n0.750000 0.250000 0.500000 Rh\n",
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{
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"structure_string": "La1 Ge3 Rh1\n1.0\n-2.230222 2.230222 5.100245\n2.230222 -2.230222 5.100245\n2.230222 2.230222 -5.100245\nLa Ge Rh\n1 3 1\ndirect\n0.578878 0.578878 0.000000 La\n0.341803 0.841803 0.500000 Ge\n0.841803 0.341803 0.500000 Ge\n0.000874 0.000874 0.000000 Ge\n0.238643 0.238643 0.000000 Rh\n",
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]
}