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{
"id": "mp-24410",
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{
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{
"id": "mp-1517726",
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"structure_string": "Sr1 Pr1 Dy1 Co1 O6\n1.0\n0.000000 -4.024030 -4.024030\n4.024030 -0.000000 -4.024030\n4.024030 -4.024030 0.000000\nSr Pr Dy Co O\n1 1 1 1 6\ndirect\n0.750000 0.750000 0.750000 Sr\n0.250000 0.250000 0.250000 Pr\n0.500000 0.500000 0.500000 Dy\n-0.000000 -0.000000 -0.000000 Co\n0.768880 0.231120 0.231120 O\n0.231120 0.768880 0.768880 O\n0.768880 0.231120 0.768880 O\n0.231120 0.768880 0.231120 O\n0.768880 0.768880 0.231120 O\n0.231120 0.231120 0.768880 O\n",
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{
"id": "mp-1517551",
"created_at": "2022-09-04T14:41:46.385339Z",
"structure_string": "Sr2 Cr1 In1 O6\n1.0\n-0.000000 -4.024022 -4.024022\n4.024022 0.000000 -4.024022\n4.024022 -4.024022 0.000000\nSr Cr In O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Sr\n0.750000 0.750000 0.750000 Sr\n-0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.500000 In\n0.764765 0.235235 0.235235 O\n0.235235 0.764765 0.764765 O\n0.764765 0.235235 0.764765 O\n0.235235 0.764765 0.235235 O\n0.764765 0.764765 0.235235 O\n0.235235 0.235235 0.764765 O\n",
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"spacegroup": 225
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{
"id": "mp-553881",
"created_at": "2022-09-04T14:40:36.205149Z",
"structure_string": "Si4 O8\n1.0\n4.251799 0.000000 0.000000\n0.000000 4.303705 0.000000\n0.000000 4.187809 7.121797\nSi O\n4 8\ndirect\n0.137794 0.301732 0.120707 Si\n0.547443 0.016979 0.995671 Si\n0.452557 0.016979 0.495671 Si\n0.862206 0.301732 0.620707 Si\n0.247740 0.991808 0.336459 O\n0.715548 0.335126 0.426697 O\n0.284452 0.335126 0.926697 O\n0.691934 0.662061 0.608564 O\n0.784593 0.139663 0.116711 O\n0.215407 0.139663 0.616711 O\n0.752260 0.991808 0.836459 O\n0.308066 0.662061 0.108564 O\n",
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"elements": [
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"volume": 130.31812132494207,
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"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy": -96.16852631,
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"spacegroup": 7
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{
"id": "mp-1225458",
"created_at": "2022-09-04T14:42:12.741956Z",
"structure_string": "Dy2 Ti1 Cu1 O6\n1.0\n0.000056 -3.637859 0.000012\n-3.150582 1.818979 0.000001\n0.000026 0.000037 -11.368133\nDy Ti Cu O\n2 1 1 6\ndirect\n0.000021 0.000010 0.271940 Dy\n0.999994 0.999999 0.723955 Dy\n0.666738 0.333368 0.998008 Ti\n0.333234 0.666614 0.498036 Cu\n0.666689 0.333344 0.162209 O\n0.333311 0.666656 0.666760 O\n0.999950 0.999974 0.997953 O\n0.000058 0.000029 0.497914 O\n0.333339 0.666670 0.329391 O\n0.666667 0.333335 0.833834 O\n",
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"volume": 130.2932555886354,
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"formula_full": "Dy2 Ti1 Cu1 O6",
"formula_reduced": "Dy2TiCuO6",
"formula_anonymous": "ABC2D6",
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{
"id": "mp-4836",
"created_at": "2022-09-04T14:47:38.099536Z",
"structure_string": "Yb1 Mn2 Sb2\n1.0\n2.226132 -3.855774 0.000000\n2.226132 3.855774 0.000000\n0.000000 0.000000 7.589716\nYb Mn Sb\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Yb\n0.666667 0.333333 0.380475 Mn\n0.333333 0.666667 0.619525 Mn\n0.666667 0.333333 0.746091 Sb\n0.333333 0.666667 0.253909 Sb\n",
"nsites": 5,
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"volume": 130.2920760256789,
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"formula_full": "Yb1 Mn2 Sb2",
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"spacegroup": 164
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{
"id": "mp-1185406",
"created_at": "2022-09-04T14:46:22.438190Z",
"structure_string": "Li1 Pr3\n1.0\n5.069571 0.000000 0.000000\n0.000000 5.069571 0.000000\n0.000000 0.000000 5.069571\nLi Pr\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.500000 Pr\n0.500000 0.500000 0.000000 Pr\n0.500000 0.000000 0.500000 Pr\n",
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{
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"structure_string": "Mg3 Cd3\n1.0\n1.630195 -8.029471 0.000000\n1.630195 8.029471 0.000000\n0.000000 0.000000 4.976840\nMg Cd\n3 3\ndirect\n0.994839 0.005161 0.000000 Mg\n0.665108 0.334892 0.000000 Mg\n0.782518 0.217482 0.500000 Mg\n0.330093 0.669907 0.000000 Cd\n0.446111 0.553889 0.500000 Cd\n0.114659 0.885341 0.500000 Cd\n",
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{
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"structure_string": "Ca2 Zr1 Ti1 O6\n1.0\n-0.000000 -4.023693 -4.023693\n4.023693 0.000000 -4.023693\n4.023693 -4.023693 -0.000000\nCa Zr Ti O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750000 0.750000 0.750000 Ca\n0.500000 0.500000 0.500000 Zr\n0.000000 -0.000000 -0.000000 Ti\n0.757883 0.242117 0.242117 O\n0.242117 0.757883 0.757883 O\n0.757883 0.242117 0.757883 O\n0.242117 0.757883 0.242117 O\n0.757883 0.757883 0.242117 O\n0.242117 0.242117 0.757883 O\n",
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{
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{
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]
}