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{
"id": "jvasp-94097",
"created_at": "2022-09-04T14:35:51.000764Z",
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"structure_string": "Mg6 Ni1 W1\n1.0\n6.136312 -0.166949 0.000000\n-3.212739 5.230727 0.000000\n0.000000 0.000000 4.702060\nMg Ni W\n6 1 1\ndirect\n0.177174 0.846957 0.250000 Mg\n0.653043 0.322826 0.250000 Mg\n0.673971 0.826029 0.250000 Mg\n0.321924 0.666534 0.750000 Mg\n0.833466 0.178076 0.750000 Mg\n0.829717 0.670283 0.750000 Mg\n0.199780 0.300220 0.250000 Ni\n0.310925 0.189075 0.750000 W\n",
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{
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"structure_string": "Mg6 Al1 Si1\n1.0\n6.140281 -0.041377 0.000000\n-3.105975 5.296952 0.000000\n0.000000 0.000000 5.081168\nMg Al Si\n6 1 1\ndirect\n0.166564 0.846000 0.250000 Mg\n0.654000 0.333435 0.250000 Mg\n0.665817 0.834182 0.250000 Mg\n0.335293 0.657601 0.750000 Mg\n0.842398 0.164706 0.750000 Mg\n0.835105 0.664894 0.750000 Mg\n0.158962 0.341038 0.250000 Al\n0.341860 0.158139 0.750000 Si\n",
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{
"id": "jvasp-94134",
"created_at": "2022-09-04T14:35:49.105366Z",
"updated_at": "2022-09-04T14:35:49.105402Z",
"structure_string": "Mg6 Co1 Si1\n1.0\n6.015526 -0.082629 0.000000\n-3.079321 5.333539 0.000000\n0.000000 0.000000 4.672316\nMg Co Si\n6 1 1\ndirect\n0.670902 0.333095 0.250000 Mg\n0.670902 0.837805 0.250000 Mg\n0.321543 0.172523 0.750001 Mg\n0.321544 0.649021 0.750001 Mg\n0.849786 0.174893 0.750001 Mg\n0.837488 0.668745 0.750001 Mg\n0.164523 0.332261 0.250000 Co\n0.163316 0.831657 0.250000 Si\n",
"nsites": 8,
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"formula_full": "Mg6 Co1 Si1",
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"spacegroup": 38
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{
"id": "jvasp-93086",
"created_at": "2022-09-04T14:35:48.465203Z",
"updated_at": "2022-09-04T14:35:48.465217Z",
"structure_string": "Na1 Sr1 Mg6\n1.0\n7.065786 -0.196899 0.000000\n-3.703413 6.020700 0.000000\n0.000000 0.000000 5.316373\nNa Sr Mg\n1 1 6\ndirect\n0.148281 0.351720 0.250000 Na\n0.315613 0.184387 0.750000 Sr\n0.176309 0.825989 0.250000 Mg\n0.674012 0.323692 0.250000 Mg\n0.689698 0.810303 0.250000 Mg\n0.335421 0.693833 0.750000 Mg\n0.806167 0.164579 0.750000 Mg\n0.854504 0.645497 0.750000 Mg\n",
"nsites": 8,
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"elements": [
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"density": 1.9156685981370511,
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"volume": 222.28701537073783,
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"formula_full": "Na1 Sr1 Mg6",
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"formula_anonymous": "ABC6",
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"spacegroup": 38
},
{
"id": "jvasp-92894",
"created_at": "2022-09-04T14:35:54.510127Z",
"updated_at": "2022-09-04T14:35:54.510152Z",
"structure_string": "Mg6 Bi1 Mo1\n1.0\n6.267580 0.055156 0.000000\n-3.086024 5.345149 0.000000\n0.000000 0.000000 5.087436\nMg Bi Mo\n6 1 1\ndirect\n0.665907 0.329030 0.250000 Mg\n0.665907 0.836877 0.250000 Mg\n0.332055 0.183866 0.750001 Mg\n0.332055 0.648192 0.750001 Mg\n0.854393 0.177198 0.750001 Mg\n0.816142 0.658072 0.750001 Mg\n0.158410 0.829205 0.250000 Bi\n0.175134 0.337567 0.250000 Mo\n",
"nsites": 8,
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"elements": [
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"density": 4.3694379796718374,
"density_atomic": 0.046701448189094746,
"volume": 171.30089772822248,
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"formula_full": "Mg6 Bi1 Mo1",
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"spacegroup": 38
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{
"id": "jvasp-93162",
"created_at": "2022-09-04T14:35:51.385214Z",
"updated_at": "2022-09-04T14:35:51.385239Z",
"structure_string": "Li1 Mg6 C1\n1.0\n7.654925 -0.477772 0.000000\n-4.241226 7.346016 0.000000\n0.000000 0.000000 3.055494\nLi Mg C\n1 6 1\ndirect\n0.387054 0.443526 0.250000 Li\n0.652084 0.271787 0.250000 Mg\n0.652084 0.880297 0.250000 Mg\n0.205595 0.025970 0.749999 Mg\n0.205595 0.679626 0.749999 Mg\n0.981450 0.240726 0.749999 Mg\n0.827046 0.663523 0.749999 Mg\n0.089098 0.794548 0.250000 C\n",
"nsites": 8,
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"elements": [
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"density": 1.6520468919959477,
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"formula_full": "Li1 Mg6 C1",
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{
"id": "jvasp-94086",
"created_at": "2022-09-04T14:35:54.799297Z",
"updated_at": "2022-09-04T14:35:54.799322Z",
"structure_string": "Mg6 Ga1 Ni1\n1.0\n6.054956 -0.139272 0.000000\n-3.148091 5.452653 0.000000\n0.000000 0.000000 4.704133\nMg Ga Ni\n6 1 1\ndirect\n0.676717 0.336150 0.250000 Mg\n0.676717 0.840566 0.250000 Mg\n0.318603 0.171839 0.750000 Mg\n0.318603 0.646763 0.750000 Mg\n0.844358 0.172178 0.750000 Mg\n0.835632 0.667816 0.750000 Mg\n0.171464 0.835731 0.250000 Ga\n0.157911 0.328955 0.250000 Ni\n",
"nsites": 8,
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"elements": [
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],
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"density": 2.971649465645792,
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"volume": 153.24716671299737,
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"formula_full": "Mg6 Ga1 Ni1",
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{
"id": "jvasp-93056",
"created_at": "2022-09-04T14:35:55.312670Z",
"updated_at": "2022-09-04T14:35:55.312703Z",
"structure_string": "Na1 Mg6 Ga1\n1.0\n6.411576 0.024882 0.000000\n-3.184240 5.515265 0.000000\n0.000000 0.000000 5.125458\nNa Mg Ga\n1 6 1\ndirect\n0.166124 0.333062 0.250000 Na\n0.667666 0.332434 0.250000 Mg\n0.667666 0.835230 0.250000 Mg\n0.330080 0.158936 0.750000 Mg\n0.330080 0.671142 0.750000 Mg\n0.826578 0.163288 0.750000 Mg\n0.835339 0.667669 0.750000 Mg\n0.176469 0.838233 0.250000 Ga\n",
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"volume": 181.65018308061806,
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"formula_full": "Na1 Mg6 Ga1",
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"formula_anonymous": "ABC6",
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{
"id": "jvasp-91977",
"created_at": "2022-09-04T14:35:59.488981Z",
"updated_at": "2022-09-04T14:35:59.489010Z",
"structure_string": "Ni1 Sn1 F6\n1.0\n4.519369 0.056084 3.121600\n1.667367 4.200920 3.121601\n0.081506 0.056083 5.492035\nNi Sn F\n1 1 6\ndirect\n0.500001 0.499999 0.500000 Ni\n0.000000 0.000000 0.000000 Sn\n0.251192 0.898716 0.600940 F\n0.898718 0.600940 0.251191 F\n0.399060 0.748809 0.101283 F\n0.101284 0.399059 0.748809 F\n0.748810 0.101282 0.399060 F\n0.600942 0.251190 0.898717 F\n",
"nsites": 8,
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"formula_full": "Ni1 Sn1 F6",
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"spacegroup": 148
},
{
"id": "jvasp-94060",
"created_at": "2022-09-04T14:35:56.519816Z",
"updated_at": "2022-09-04T14:35:56.519837Z",
"structure_string": "Mg6 Nb1 V1\n1.0\n6.249031 0.192212 0.000000\n-2.958056 5.123502 0.000000\n0.000000 0.000000 4.964860\nMg Nb V\n6 1 1\ndirect\n0.654022 0.327574 0.250000 Mg\n0.654022 0.826447 0.250000 Mg\n0.330268 0.162636 0.750000 Mg\n0.330267 0.667632 0.750000 Mg\n0.863336 0.181669 0.750000 Mg\n0.855384 0.677692 0.750000 Mg\n0.153233 0.826616 0.250000 Nb\n0.159466 0.329732 0.250000 V\n",
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],
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{
"id": "jvasp-93090",
"created_at": "2022-09-04T14:35:54.197877Z",
"updated_at": "2022-09-04T14:35:54.197903Z",
"structure_string": "Mg6 Ga1 Si1\n1.0\n6.137309 -0.061782 0.000000\n-3.122160 5.284174 0.000000\n0.000000 0.000000 5.097184\nMg Ga Si\n6 1 1\ndirect\n0.159102 0.853602 0.250000 Mg\n0.646397 0.340897 0.250000 Mg\n0.659390 0.840610 0.250000 Mg\n0.338435 0.642011 0.749999 Mg\n0.857989 0.161565 0.749999 Mg\n0.838787 0.661213 0.749999 Mg\n0.360176 0.139824 0.749999 Ga\n0.139723 0.360277 0.250000 Si\n",
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],
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{
"id": "jvasp-93144",
"created_at": "2022-09-04T14:35:57.301131Z",
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"structure_string": "Na1 Mg6 Si1\n1.0\n6.358379 0.007213 0.000000\n-3.172943 5.510124 0.000000\n0.000000 0.000000 5.053760\nNa Mg Si\n1 6 1\ndirect\n0.328767 0.171233 0.750000 Na\n0.164221 0.825831 0.250000 Mg\n0.674169 0.335778 0.250000 Mg\n0.668883 0.831117 0.250000 Mg\n0.328743 0.659034 0.750000 Mg\n0.840965 0.171256 0.750000 Mg\n0.835526 0.664473 0.750000 Mg\n0.158726 0.341274 0.250000 Si\n",
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}