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{
"id": "jvasp-79164",
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"structure_string": "Mg3 Ga1\n1.0\n6.168729 -0.137430 0.000000\n-1.601690 2.774210 -0.000000\n0.000000 0.000000 4.951562\nMg Ga\n3 1\ndirect\n0.671581 0.671581 0.250000 Mg\n0.324592 0.324592 0.750000 Mg\n0.834642 0.334642 0.750000 Mg\n0.169185 0.669185 0.250000 Ga\n",
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{
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"structure_string": "Mg4 Ga4\n1.0\n5.651801 0.000000 0.000000\n-0.000000 5.651801 0.000000\n-0.000000 -0.000000 5.651801\nMg Ga\n4 4\ndirect\n0.500000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Ga\n0.500000 0.500000 0.000000 Ga\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Ga\n",
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{
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"structure_string": "Mg3 Ga1\n1.0\n-2.173595 2.173595 4.382132\n2.173595 -2.173595 4.382132\n2.173595 2.173595 -4.382132\nMg Ga\n3 1\ndirect\n0.500000 0.500000 0.000000 Mg\n0.750001 0.250000 0.500001 Mg\n0.250000 0.750001 0.500001 Mg\n0.000000 0.000000 0.000000 Ga\n",
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{
"id": "jvasp-78863",
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"updated_at": "2022-09-04T14:37:11.418605Z",
"structure_string": "Mg1 Ga3\n1.0\n3.225057 -0.000000 -0.000000\n-1.612529 2.792981 0.000000\n-0.000000 0.000000 8.812117\nMg Ga\n1 3\ndirect\n0.333333 0.666667 0.500000 Mg\n0.333333 0.666667 0.000000 Ga\n0.000000 0.000000 0.757605 Ga\n0.000000 0.000000 0.242395 Ga\n",
"nsites": 4,
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"volume": 79.37534589455083,
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"spacegroup": 187
},
{
"id": "jvasp-78557",
"created_at": "2022-09-04T14:37:10.221697Z",
"updated_at": "2022-09-04T14:37:10.221722Z",
"structure_string": "Mg1 Ga1\n1.0\n3.238680 -0.000000 -0.000000\n-1.619340 2.804779 -0.000000\n-0.000000 0.000000 4.388980\nMg Ga\n1 1\ndirect\n0.000000 0.000000 0.000000 Mg\n0.666667 0.333333 0.500000 Ga\n",
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"volume": 39.868535993766045,
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"spacegroup": 187
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{
"id": "jvasp-79753",
"created_at": "2022-09-04T14:37:11.374268Z",
"updated_at": "2022-09-04T14:37:11.374289Z",
"structure_string": "Mg2 Ga2\n1.0\n4.794630 -0.000000 -0.000000\n-2.397314 4.152271 0.000000\n-0.000000 -0.000000 5.440267\nMg Ga\n2 2\ndirect\n0.666667 0.333333 0.562500 Mg\n0.333334 0.666667 0.062500 Mg\n0.666667 0.333333 0.062500 Ga\n0.333334 0.666667 0.562500 Ga\n",
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"volume": 108.30811648676016,
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"formula_full": "Mg2 Ga2",
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"spacegroup": 194
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{
"id": "jvasp-91891",
"created_at": "2022-09-04T14:35:56.205015Z",
"updated_at": "2022-09-04T14:35:56.205043Z",
"structure_string": "Mg7 Fe1\n1.0\n6.206290 -0.000000 -0.000000\n-3.103146 5.374804 -0.000000\n-0.000000 -0.000000 4.902065\nMg Fe\n7 1\ndirect\n0.167215 0.833607 0.250000 Mg\n0.666392 0.332784 0.250000 Mg\n0.666391 0.833607 0.250000 Mg\n0.324738 0.175262 0.749999 Mg\n0.324737 0.649476 0.749999 Mg\n0.850523 0.175262 0.749999 Mg\n0.833332 0.666666 0.749999 Mg\n0.166667 0.333333 0.250000 Fe\n",
"nsites": 8,
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"elements": [
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"formula_full": "Mg7 Fe1",
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{
"id": "jvasp-123922",
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"structure_string": "Mg1 Fe1\n1.0\n1.385140 -2.399134 0.000000\n1.385140 2.399134 -0.000000\n0.000000 0.000000 4.452933\nMg Fe\n1 1\ndirect\n0.333334 0.666666 0.250000 Mg\n0.666666 0.333334 0.749999 Fe\n",
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"spacegroup": 187
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{
"id": "jvasp-79188",
"created_at": "2022-09-04T14:37:02.184622Z",
"updated_at": "2022-09-04T14:37:02.184649Z",
"structure_string": "Mg3 Fe1\n1.0\n5.997029 0.051763 0.000000\n-1.476843 2.557968 0.000000\n-0.000000 0.000000 4.747602\nMg Fe\n3 1\ndirect\n0.660662 0.660662 0.250000 Mg\n0.323203 0.323203 0.750000 Mg\n0.855759 0.355759 0.750000 Mg\n0.160377 0.660377 0.250000 Fe\n",
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"spacegroup": 25
},
{
"id": "jvasp-107428",
"created_at": "2022-09-04T14:37:00.524878Z",
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"structure_string": "Mg2 F4\n1.0\n5.384924 0.064929 -2.112884\n-0.784942 3.598749 -4.460804\n-0.140209 -0.064929 5.782908\nMg F\n2 4\ndirect\n0.860429 0.610430 0.250001 Mg\n0.139570 0.389570 0.750000 Mg\n0.089018 0.839018 0.250001 F\n0.500000 0.500000 0.000001 F\n0.910982 0.160982 0.750001 F\n0.000000 0.500000 0.500001 F\n",
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},
{
"id": "jvasp-57661",
"created_at": "2022-09-04T14:37:55.095002Z",
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"structure_string": "Mg4 F8\n1.0\n4.975400 0.000000 0.000000\n-0.000000 4.975400 0.000000\n-0.000000 -0.000000 4.975400\nMg F\n4 8\ndirect\n0.000000 0.500000 0.500000 Mg\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.341024 0.158976 0.841024 F\n0.158976 0.841024 0.341024 F\n0.841024 0.341024 0.158976 F\n0.658976 0.658976 0.658976 F\n0.341024 0.341024 0.341024 F\n0.158976 0.658976 0.841024 F\n0.841024 0.158976 0.658976 F\n0.658976 0.841024 0.158976 F\n",
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{
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"created_at": "2022-09-04T14:36:02.054790Z",
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"structure_string": "Mg2 F4\n1.0\n0.000000 0.000000 3.068498\n4.642279 0.000000 0.000000\n-0.000000 4.646785 0.000000\nMg F\n2 4\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.500000 0.802632 0.197150 F\n0.500000 0.197368 0.802851 F\n0.000000 0.302632 0.302850 F\n0.000000 0.697369 0.697151 F\n",
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