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{
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"structure_string": "Li4 V6 W2 O16\n1.0\n5.845730 -0.000002 -0.000027\n-2.922868 5.062556 0.000055\n0.000333 -0.000576 9.710324\nLi V W O\n4 6 2 16\ndirect\n0.333344 0.666698 0.899575 Li\n0.000040 0.999966 0.991015 Li\n0.999959 0.999926 0.491015 Li\n0.666655 0.333352 0.399575 Li\n0.826242 0.652501 0.713893 V\n0.347539 0.173792 0.713877 V\n0.826249 0.173783 0.713880 V\n0.173751 0.347535 0.213880 V\n0.173757 0.826258 0.213894 V\n0.652461 0.826255 0.213878 V\n0.333327 0.666663 0.489030 W\n0.666672 0.333337 0.989030 W\n0.339102 0.169553 0.095612 O\n0.830452 0.660916 0.095618 O\n0.666688 0.333365 0.597928 O\n0.517614 0.035245 0.847430 O\n0.517625 0.482412 0.847447 O\n0.660898 0.830452 0.595612 O\n0.482385 0.517630 0.347430 O\n0.035214 0.517634 0.347442 O\n0.169547 0.339086 0.595594 O\n0.000019 0.000039 0.805573 O\n0.999981 0.000022 0.305573 O\n0.333311 0.666676 0.097928 O\n0.964785 0.482419 0.847441 O\n0.169548 0.830464 0.595618 O\n0.482375 0.964788 0.347447 O\n0.830453 0.169540 0.095594 O\n",
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{
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"structure_string": "Li4 V6 Te2 O16\n1.0\n2.929507 -5.074054 -0.000000\n2.929507 5.074054 -0.000000\n-0.000000 -0.000000 10.205234\nLi V Te O\n4 6 2 16\ndirect\n0.666667 0.333334 0.898842 Li\n0.000000 0.000000 0.990321 Li\n0.000000 0.000000 0.490321 Li\n0.333334 0.666667 0.398842 Li\n0.176856 0.353714 0.719171 V\n0.646288 0.823143 0.719171 V\n0.176858 0.823144 0.719171 V\n0.823143 0.646288 0.219171 V\n0.823144 0.176858 0.219171 V\n0.353714 0.176856 0.219171 V\n0.666667 0.333334 0.505400 Te\n0.333334 0.666667 0.005400 Te\n0.681807 0.840905 0.102140 O\n0.159100 0.318195 0.102140 O\n0.333334 0.666667 0.602296 O\n0.490373 0.980749 0.828876 O\n0.490377 0.509628 0.828876 O\n0.318195 0.159100 0.602140 O\n0.509628 0.490377 0.328876 O\n0.980749 0.490373 0.328876 O\n0.840905 0.681807 0.602140 O\n0.000000 0.000000 0.806452 O\n0.000000 0.000000 0.306452 O\n0.666667 0.333334 0.102296 O\n0.019252 0.509624 0.828876 O\n0.840901 0.159097 0.602140 O\n0.509624 0.019252 0.328876 O\n0.159097 0.840901 0.102140 O\n",
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{
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"structure_string": "Li4 V1 Te3 O12\n1.0\n8.804499 -0.000000 0.000000\n0.000000 4.945177 0.293830\n0.000000 0.034522 5.173005\nLi V Te O\n4 1 3 12\ndirect\n0.305877 0.000000 -0.000000 Li\n0.133172 0.500000 -0.000000 Li\n0.702222 -0.000000 0.500000 Li\n0.824229 0.500000 0.500000 Li\n0.895659 0.000000 -0.000000 V\n0.602501 0.500000 -0.000000 Te\n0.076014 -0.000000 0.500000 Te\n0.397875 0.500000 0.500000 Te\n0.055440 0.789001 0.191424 O\n0.581090 0.292010 0.334491 O\n0.905584 0.198940 0.312345 O\n0.225047 0.219947 0.308321 O\n0.225047 0.780053 0.691678 O\n0.441722 0.278192 0.853942 O\n0.581090 0.707990 0.665508 O\n0.055440 0.210999 0.808575 O\n0.441722 0.721808 0.146057 O\n0.751806 0.259640 0.850916 O\n0.905584 0.801060 0.687654 O\n0.751806 0.740360 0.149083 O\n",
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"structure_string": "Li4 V6 Te2 O16\n1.0\n5.115323 -0.009574 2.837950\n1.591834 9.595472 -2.837157\n-0.136029 0.094869 6.274790\nLi V Te O\n4 6 2 16\ndirect\n0.316294 0.561227 0.367401 Li\n0.816295 0.061231 0.367401 Li\n0.186417 0.937863 0.627156 Li\n0.686435 0.437860 0.627155 Li\n-0.002967 0.509252 0.005950 V\n0.734637 0.246862 0.005947 V\n0.497013 0.009255 0.005954 V\n0.759413 0.746862 0.005948 V\n0.234624 0.746867 0.005964 V\n0.259408 0.246867 0.005960 V\n0.736672 0.754437 0.526626 Te\n0.236704 0.254437 0.526626 Te\n0.652282 0.624820 0.222187 O\n0.878307 0.373903 0.775492 O\n0.378277 0.873909 0.775518 O\n0.346207 0.373908 0.775516 O\n0.846203 0.873903 0.775488 O\n0.152282 0.124832 0.222224 O\n0.625526 0.124821 0.222192 O\n0.609007 0.130330 0.781974 O\n0.388900 0.361444 0.222206 O\n0.888888 0.861445 0.222206 O\n0.907081 0.364307 0.185834 O\n0.407081 0.864307 0.185837 O\n0.612239 0.639948 0.775521 O\n0.109017 0.630331 0.781977 O\n0.125489 0.624831 0.222225 O\n0.112244 0.139948 0.775519 O\n",
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"structure_string": "Li4 V1 Te3 O12\n1.0\n0.000000 4.949290 0.035914\n8.818522 0.000000 0.000000\n0.000000 -0.305274 -5.160590\nLi V Te O\n4 1 3 12\ndirect\n0.000000 0.307442 0.000000 Li\n0.500000 0.132439 0.000000 Li\n0.000000 0.701782 0.500000 Li\n0.500000 0.826178 0.500000 Li\n0.000000 0.895744 0.000000 V\n0.500000 0.602585 0.000000 Te\n0.000000 0.076106 0.500000 Te\n0.500000 0.398275 0.500000 Te\n0.787998 0.054636 0.807609 O\n0.291817 0.580420 0.665398 O\n0.198972 0.905902 0.686987 O\n0.218489 0.224593 0.692817 O\n0.781512 0.224593 0.307184 O\n0.278286 0.442290 0.146063 O\n0.708184 0.580420 0.334602 O\n0.212003 0.054636 0.192392 O\n0.721715 0.442290 0.853938 O\n0.260272 0.751344 0.148562 O\n0.801029 0.905902 0.313014 O\n0.739729 0.751344 0.851439 O\n",
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{
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"created_at": "2022-09-04T14:35:43.927037Z",
"updated_at": "2022-09-04T14:35:43.927063Z",
"structure_string": "Li2 V3 Sn1 O8\n1.0\n6.010721 0.132187 0.093470\n3.119837 5.139344 0.093470\n3.119837 1.801239 4.814263\nLi V Sn O\n2 3 1 8\ndirect\n0.119714 0.119714 0.119714 Li\n0.506901 0.506901 0.506900 Li\n0.048332 0.478772 0.478772 V\n0.478772 0.048331 0.478772 V\n0.478773 0.478772 0.048331 V\n0.870941 0.870940 0.870939 Sn\n0.246442 0.246442 0.246441 O\n0.252540 0.252540 0.724253 O\n0.252540 0.724254 0.252539 O\n0.724254 0.252540 0.252539 O\n0.287241 0.748144 0.748143 O\n0.748144 0.287241 0.748143 O\n0.748144 0.748144 0.287240 O\n0.737266 0.737266 0.737265 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"Sn",
"O"
],
"chemical_system": "Li-O-Sn-V",
"density": 4.741388571930409,
"density_atomic": 0.0966944891570384,
"volume": 144.78591408930296,
"volume_molar": 6.22800824793607,
"formula_full": "Li2 V3 Sn1 O8",
"formula_reduced": "Li2V3SnO8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.850493735714286,
"spacegroup": 160
},
{
"id": "jvasp-119339",
"created_at": "2022-09-04T14:38:44.277762Z",
"updated_at": "2022-09-04T14:38:44.277788Z",
"structure_string": "Li4 V4 Sn2 O12\n1.0\n4.572360 0.000173 -2.564418\n0.001119 10.072924 0.000697\n0.023369 0.000128 5.242347\nLi V Sn O\n4 4 2 12\ndirect\n0.646334 0.750013 0.146143 Li\n0.853839 0.249988 0.353684 Li\n0.146139 0.750018 0.646350 Li\n0.353662 0.249984 0.853850 Li\n0.343126 -0.000001 0.656884 V\n0.156885 0.499998 0.843111 V\n0.843176 0.499997 0.156820 V\n0.656825 -0.000001 0.343183 V\n0.999971 0.000002 0.000025 Sn\n0.500025 0.500001 0.499965 Sn\n0.157998 0.391995 0.510650 O\n0.989352 0.891994 0.342116 O\n0.842051 0.608007 0.489287 O\n0.510708 0.391993 0.157946 O\n0.342065 0.891994 0.989409 O\n0.165706 0.606523 0.165631 O\n0.834361 0.393476 0.834285 O\n0.665744 0.893472 0.665807 O\n0.334206 0.106527 0.334269 O\n0.489345 0.608005 0.842000 O\n0.657889 0.108005 0.010655 O\n0.010598 0.108004 0.657940 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Li",
"V",
"Sn",
"O"
],
"chemical_system": "Li-O-Sn-V",
"density": 4.534263975968722,
"density_atomic": 0.0908900846103142,
"volume": 242.05060534736748,
"volume_molar": 6.6257400747502535,
"formula_full": "Li4 V4 Sn2 O12",
"formula_reduced": "Li2V2SnO6",
"formula_anonymous": "AB2C2D6",
"energy_above_hull": 2.5536646454545453,
"spacegroup": 64
}
]
}