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{
"id": "jvasp-76932",
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"updated_at": "2022-09-04T14:38:11.677475Z",
"structure_string": "Li2 Mg1 Au1\n1.0\n-9.706755 0.000000 -5.604198\n-6.217132 -0.243214 -0.440007\n-5.193310 2.652591 -2.213318\nLi Mg Au\n2 1 1\ndirect\n0.717764 -0.000001 -0.000000 Li\n0.282236 -0.000000 -0.000000 Li\n0.000000 0.000000 0.000000 Mg\n0.500000 -0.000001 -0.000000 Au\n",
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{
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"structure_string": "Li1 Lu1 Au2\n1.0\n0.000000 3.361247 3.361247\n3.361247 -0.000000 3.361247\n3.361247 3.361247 0.000000\nLi Lu Au\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.750001 0.750001 0.750001 Lu\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n",
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{
"id": "jvasp-116255",
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"structure_string": "Li2 Au1\n1.0\n2.871317 -0.026454 -0.028138\n-1.461517 -4.536781 -0.081889\n-1.482834 -2.789136 -3.572886\nLi Au\n2 1\ndirect\n0.868041 0.645459 0.747985 Li\n0.551885 0.328246 0.430590 Li\n0.209807 -0.013130 0.089287 Au\n",
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"elements": [
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"volume": 46.096039856087664,
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"formula_full": "Li2 Au1",
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},
{
"id": "jvasp-103266",
"created_at": "2022-09-04T14:36:42.307680Z",
"updated_at": "2022-09-04T14:36:42.307694Z",
"structure_string": "Li2 Au6\n1.0\n5.654299 -0.000000 0.000000\n-2.827150 4.896767 -0.000000\n-0.000000 0.000000 4.834525\nLi Au\n2 6\ndirect\n0.666667 0.333333 0.250000 Li\n0.333333 0.666667 0.749999 Li\n0.831322 0.168679 0.749999 Au\n0.662642 0.831322 0.250000 Au\n0.168679 0.337358 0.250000 Au\n0.168679 0.831322 0.250000 Au\n0.831322 0.662642 0.749999 Au\n0.337358 0.168679 0.749999 Au\n",
"nsites": 8,
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"elements": [
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],
"chemical_system": "Au-Li",
"density": 14.832780008656508,
"density_atomic": 0.05976514349673573,
"volume": 133.85728757493817,
"volume_molar": 10.07634284410096,
"formula_full": "Li2 Au6",
"formula_reduced": "LiAu3",
"formula_anonymous": "AB3",
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"spacegroup": 194
},
{
"id": "jvasp-38449",
"created_at": "2022-09-04T14:37:49.432847Z",
"updated_at": "2022-09-04T14:37:49.432870Z",
"structure_string": "Li1 Au3\n1.0\n-1.998315 1.998315 4.200303\n1.998315 -1.998315 4.200303\n1.998315 1.998315 -4.200303\nLi Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.750000 0.250001 0.499999 Au\n0.250001 0.750000 0.499999 Au\n0.500000 0.500000 0.000000 Au\n",
"nsites": 4,
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"elements": [
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"volume": 67.09165553354114,
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"formula_full": "Li1 Au3",
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},
{
"id": "jvasp-16446",
"created_at": "2022-09-04T14:37:57.253335Z",
"updated_at": "2022-09-04T14:37:57.253362Z",
"structure_string": "Li1 Au3\n1.0\n4.052605 0.000000 0.000000\n0.000000 4.052605 0.000000\n0.000000 -0.000000 4.052605\nLi Au\n1 3\ndirect\n0.000000 0.000000 0.000000 Li\n0.500001 0.500001 0.000000 Au\n0.500001 0.000000 0.500001 Au\n0.000000 0.500001 0.500001 Au\n",
"nsites": 4,
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"elements": [
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],
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"volume": 66.55839300538135,
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"formula_full": "Li1 Au3",
"formula_reduced": "LiAu3",
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},
{
"id": "jvasp-16445",
"created_at": "2022-09-04T14:37:56.969549Z",
"updated_at": "2022-09-04T14:37:56.969576Z",
"structure_string": "Li3 Au1\n1.0\n3.815069 -0.000000 2.202632\n1.271690 3.596882 2.202632\n-0.000000 -0.000000 4.405262\nLi Au\n3 1\ndirect\n0.750000 0.750000 0.749999 Li\n0.500000 0.500000 0.499999 Li\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Au\n",
"nsites": 4,
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"elements": [
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},
{
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"created_at": "2022-09-04T14:38:19.060929Z",
"updated_at": "2022-09-04T14:38:19.060945Z",
"structure_string": "Li1 Au1\n1.0\n3.120692 -0.000000 0.000000\n0.000000 3.120692 0.000000\n-0.000000 -0.000000 3.120692\nLi Au\n1 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Au\n",
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"elements": [
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"spacegroup": 221
},
{
"id": "jvasp-106257",
"created_at": "2022-09-04T14:36:38.965707Z",
"updated_at": "2022-09-04T14:36:38.965743Z",
"structure_string": "Li3 Au1\n1.0\n3.602578 -0.346124 -2.623400\n-1.134622 3.436715 -2.623400\n0.276394 0.346124 4.447967\nLi Au\n3 1\ndirect\n0.750000 0.250000 0.500000 Li\n0.250000 0.749999 0.499999 Li\n0.500001 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Au\n",
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],
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"formula_full": "Li3 Au1",
"formula_reduced": "Li3Au",
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},
{
"id": "jvasp-107551",
"created_at": "2022-09-04T14:37:02.358875Z",
"updated_at": "2022-09-04T14:37:02.358913Z",
"structure_string": "Li1 Au1\n1.0\n2.784629 -0.009265 3.600123\n1.223259 2.501576 3.600123\n-0.014899 -0.009265 4.551354\nLi Au\n1 1\ndirect\n0.500001 0.499999 0.499999 Li\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
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"spacegroup": 166
},
{
"id": "jvasp-116253",
"created_at": "2022-09-04T14:38:42.109996Z",
"updated_at": "2022-09-04T14:38:42.110019Z",
"structure_string": "Li2 Au1\n1.0\n4.375411 0.000000 1.513990\n0.000000 2.700958 0.000000\n0.875786 0.000000 4.546269\nLi Au\n2 1\ndirect\n-0.267003 0.000000 0.074397 Li\n0.399672 0.000000 -0.258928 Li\n0.066394 0.000000 0.407720 Au\n",
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},
{
"id": "jvasp-115177",
"created_at": "2022-09-04T14:38:45.004705Z",
"updated_at": "2022-09-04T14:38:45.004740Z",
"structure_string": "Li1 Au2\n1.0\n4.187833 0.000000 0.000000\n0.000000 2.720522 0.000000\n0.000000 0.000000 5.527585\nLi Au\n1 2\ndirect\n0.466645 0.000000 0.000000 Li\n-0.033323 0.000000 0.743588 Au\n-0.033323 0.000000 0.256413 Au\n",
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