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{
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{
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{
"id": "mp-1204825",
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"structure_string": "Gd2 Zn40 Co4\n1.0\n0.000000 7.023729 7.023729\n7.023729 0.000000 7.023729\n7.023729 7.023729 0.000000\nGd Zn Co\n2 40 4\ndirect\n0.500000 0.500000 0.500000 Gd\n0.750000 0.750000 0.750000 Gd\n0.568919 0.298942 0.298942 Zn\n0.298942 0.568919 0.833197 Zn\n0.298942 0.833197 0.568919 Zn\n0.833197 0.298942 0.298942 Zn\n0.298942 0.298942 0.568919 Zn\n0.568919 0.833197 0.298942 Zn\n0.833197 0.568919 0.298942 Zn\n0.298942 0.298942 0.833197 Zn\n0.298942 0.568919 0.298942 Zn\n0.833197 0.298942 0.568919 Zn\n0.568919 0.298942 0.833197 Zn\n0.298942 0.833197 0.298942 Zn\n0.681081 0.951058 0.951058 Zn\n0.951058 0.681081 0.416803 Zn\n0.951058 0.416803 0.681081 Zn\n0.416803 0.951058 0.951058 Zn\n0.951058 0.951058 0.681081 Zn\n0.681081 0.416803 0.951058 Zn\n0.416803 0.681081 0.951058 Zn\n0.951058 0.951058 0.416803 Zn\n0.951058 0.681081 0.951058 Zn\n0.416803 0.951058 0.681081 Zn\n0.681081 0.951058 0.416803 Zn\n0.951058 0.416803 0.951058 Zn\n0.864026 0.864026 0.135974 Zn\n0.135974 0.135974 0.864026 Zn\n0.864026 0.135974 0.864026 Zn\n0.135974 0.864026 0.135974 Zn\n0.135974 0.864026 0.864026 Zn\n0.864026 0.135974 0.135974 Zn\n0.385974 0.385974 0.114026 Zn\n0.114026 0.114026 0.385974 Zn\n0.385974 0.114026 0.385974 Zn\n0.114026 0.385974 0.114026 Zn\n0.114026 0.385974 0.385974 Zn\n0.385974 0.114026 0.114026 Zn\n0.125000 0.625000 0.625000 Zn\n0.625000 0.125000 0.625000 Zn\n0.625000 0.625000 0.125000 Zn\n0.625000 0.625000 0.625000 Zn\n0.625000 0.125000 0.125000 Co\n0.125000 0.625000 0.125000 Co\n0.125000 0.125000 0.625000 Co\n0.125000 0.125000 0.125000 Co\n",
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{
"id": "mp-755988",
"created_at": "2022-09-04T14:47:06.717130Z",
"structure_string": "Hf6 N8\n1.0\n0.000000 4.536386 4.536386\n4.536386 0.000000 4.536386\n4.536386 4.536386 0.000000\nHf N\n6 8\ndirect\n0.625000 0.625000 0.125000 Hf\n0.625000 0.625000 0.625000 Hf\n0.250000 0.250000 0.250000 Hf\n0.625000 0.125000 0.625000 Hf\n0.000000 0.000000 0.000000 Hf\n0.125000 0.625000 0.625000 Hf\n0.867223 0.867223 0.398332 N\n0.867223 0.398332 0.867223 N\n0.398332 0.867223 0.867223 N\n0.867223 0.867223 0.867223 N\n0.382777 0.382777 0.382777 N\n0.851668 0.382777 0.382777 N\n0.382777 0.382777 0.851668 N\n0.382777 0.851668 0.382777 N\n",
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"formula_full": "Hf6 N8",
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"formula_anonymous": "A3B4",
"energy": -152.39821699,
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{
"id": "mp-1196998",
"created_at": "2022-09-04T14:47:06.879696Z",
"structure_string": "K6 Ge34\n1.0\n0.000000 7.998151 7.998151\n7.998151 0.000000 7.998151\n7.998151 7.998151 0.000000\nK Ge\n6 34\ndirect\n0.125000 0.625000 0.625000 K\n0.625000 0.125000 0.625000 K\n0.625000 0.625000 0.125000 K\n0.625000 0.625000 0.625000 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 K\n0.750000 0.750000 0.750000 Ge\n0.500000 0.500000 0.500000 Ge\n0.465968 0.844677 0.844677 Ge\n0.844677 0.465968 0.844677 Ge\n0.844677 0.844677 0.465968 Ge\n0.844677 0.844677 0.844677 Ge\n0.784032 0.405323 0.405323 Ge\n0.405323 0.784032 0.405323 Ge\n0.405323 0.405323 0.784032 Ge\n0.405323 0.405323 0.405323 Ge\n0.387415 0.997636 0.997636 Ge\n0.997636 0.387415 0.617313 Ge\n0.997636 0.617313 0.387415 Ge\n0.617313 0.997636 0.997636 Ge\n0.997636 0.997636 0.387415 Ge\n0.387415 0.617313 0.997636 Ge\n0.617313 0.387415 0.997636 Ge\n0.997636 0.997636 0.617313 Ge\n0.997636 0.387415 0.997636 Ge\n0.617313 0.997636 0.387415 Ge\n0.387415 0.997636 0.617313 Ge\n0.997636 0.617313 0.997636 Ge\n0.862585 0.252364 0.252364 Ge\n0.252364 0.862585 0.632687 Ge\n0.252364 0.632687 0.862585 Ge\n0.632687 0.252364 0.252364 Ge\n0.252364 0.252364 0.862585 Ge\n0.862585 0.632687 0.252364 Ge\n0.632687 0.862585 0.252364 Ge\n0.252364 0.252364 0.632687 Ge\n0.252364 0.862585 0.252364 Ge\n0.632687 0.252364 0.862585 Ge\n0.862585 0.252364 0.632687 Ge\n0.252364 0.632687 0.252364 Ge\n",
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{
"id": "mp-1191089",
"created_at": "2022-09-04T14:47:07.102041Z",
"structure_string": "Mg12 Mn4 Ni8\n1.0\n0.000000 5.724033 5.724033\n5.724033 0.000000 5.724033\n5.724033 5.724033 0.000000\nMg Mn Ni\n12 4 8\ndirect\n0.800932 0.800932 0.199068 Mg\n0.199068 0.199068 0.800932 Mg\n0.800932 0.199068 0.800932 Mg\n0.199068 0.800932 0.199068 Mg\n0.199068 0.800932 0.800932 Mg\n0.800932 0.199068 0.199068 Mg\n0.449068 0.449068 0.050932 Mg\n0.050932 0.050932 0.449068 Mg\n0.449068 0.050932 0.449068 Mg\n0.050932 0.449068 0.050932 Mg\n0.050932 0.449068 0.449068 Mg\n0.449068 0.050932 0.050932 Mg\n0.125000 0.625000 0.625000 Mn\n0.625000 0.125000 0.625000 Mn\n0.625000 0.625000 0.125000 Mn\n0.625000 0.625000 0.625000 Mn\n0.739795 0.420068 0.420068 Ni\n0.420068 0.739795 0.420068 Ni\n0.420068 0.420068 0.739795 Ni\n0.420068 0.420068 0.420068 Ni\n0.510205 0.829932 0.829932 Ni\n0.829932 0.510205 0.829932 Ni\n0.829932 0.829932 0.510205 Ni\n0.829932 0.829932 0.829932 Ni\n",
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{
"id": "mp-755709",
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"structure_string": "Li4 Fe4 O8\n1.0\n-2.984830 5.169649 -0.000017\n-5.976671 -0.004237 0.005988\n2.984833 1.723328 4.873967\nLi Fe O\n4 4 8\ndirect\n0.500001 0.499999 0.499999 Li\n0.500001 0.999999 0.999997 Li\n0.500001 0.000000 0.500000 Li\n0.000001 0.499999 0.499999 Li\n0.000003 0.499996 0.000000 Fe\n0.499996 0.500009 0.000006 Fe\n0.999996 0.000001 0.500005 Fe\n0.999997 0.999999 0.999998 Fe\n0.242871 0.514253 0.771386 O\n0.242867 0.985749 0.242876 O\n0.228613 0.014255 0.757131 O\n0.242877 0.514251 0.242865 O\n0.757123 0.485748 0.757133 O\n0.771388 0.985744 0.242868 O\n0.757133 0.014253 0.757123 O\n0.757131 0.485746 0.228613 O\n",
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{
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{
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{
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