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{
"id": "jvasp-51133",
"created_at": "2022-09-04T14:37:04.730202Z",
"updated_at": "2022-09-04T14:37:04.730233Z",
"structure_string": "Li1 Tc2 Pd1\n1.0\n0.000000 3.040197 3.040197\n3.040197 0.000000 3.040197\n3.040197 3.040197 -0.000000\nLi Tc Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Li\n0.250000 0.250000 0.250000 Tc\n0.750001 0.750001 0.750001 Tc\n0.500000 0.500000 0.500000 Pd\n",
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{
"id": "jvasp-86231",
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"structure_string": "Li2 Sn12 Pd4\n1.0\n6.769556 0.000000 0.000000\n0.000000 6.769556 0.000000\n-0.000000 0.000000 8.765602\nLi Sn Pd\n2 12 4\ndirect\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.841559 0.658441 0.679048 Sn\n0.841559 0.658441 0.320951 Sn\n0.658441 0.158441 0.679048 Sn\n0.336278 0.163722 0.000000 Sn\n0.163722 0.663723 0.000000 Sn\n0.663723 0.836278 0.000000 Sn\n0.158441 0.341559 0.320951 Sn\n0.158441 0.341559 0.679048 Sn\n0.341559 0.841559 0.320951 Sn\n0.658441 0.158441 0.320951 Sn\n0.836278 0.336278 0.000000 Sn\n0.341559 0.841559 0.679048 Sn\n0.000000 0.000000 0.182688 Pd\n0.500000 0.500000 0.182688 Pd\n0.500000 0.500000 0.817312 Pd\n0.000000 0.000000 0.817312 Pd\n",
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},
{
"id": "jvasp-86833",
"created_at": "2022-09-04T14:35:46.705397Z",
"updated_at": "2022-09-04T14:35:46.705424Z",
"structure_string": "Li2 Sn12 Pd4\n1.0\n6.769557 0.000000 0.000000\n0.000000 6.769557 0.000000\n0.000000 0.000000 8.765435\nLi Sn Pd\n2 12 4\ndirect\n0.000000 0.000000 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.841552 0.658449 0.679065 Sn\n0.841552 0.658449 0.320935 Sn\n0.658449 0.158449 0.679065 Sn\n0.336301 0.163699 0.000000 Sn\n0.163699 0.663699 0.000000 Sn\n0.663699 0.836301 0.000000 Sn\n0.158449 0.341552 0.320935 Sn\n0.158449 0.341552 0.679065 Sn\n0.341552 0.841552 0.320935 Sn\n0.658449 0.158449 0.320935 Sn\n0.836301 0.336301 0.000000 Sn\n0.341552 0.841552 0.679065 Sn\n0.000000 0.000000 0.182662 Pd\n0.500000 0.500000 0.182662 Pd\n0.500000 0.500000 0.817339 Pd\n0.000000 0.000000 0.817339 Pd\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "Li-Pd-Sn",
"density": 7.705842673096414,
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"volume": 401.69273052418214,
"volume_molar": 13.439167586029853,
"formula_full": "Li2 Sn12 Pd4",
"formula_reduced": "Li(Sn3Pd)2",
"formula_anonymous": "AB2C6",
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"spacegroup": 127
},
{
"id": "jvasp-104949",
"created_at": "2022-09-04T14:36:46.358564Z",
"updated_at": "2022-09-04T14:36:46.358590Z",
"structure_string": "Li2 Sn1 Pd1\n1.0\n3.901222 0.000000 2.252371\n1.300407 3.678107 2.252371\n-0.000000 -0.000000 4.504743\nLi Sn Pd\n2 1 1\ndirect\n0.500000 0.500000 0.499999 Li\n0.750000 0.750001 0.749999 Li\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Pd\n",
"nsites": 4,
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"density": 6.140076194984405,
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"volume": 64.63906159835646,
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"formula_full": "Li2 Sn1 Pd1",
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"formula_anonymous": "ABC2",
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},
{
"id": "jvasp-8123",
"created_at": "2022-09-04T14:36:45.688406Z",
"updated_at": "2022-09-04T14:36:45.688432Z",
"structure_string": "Li1 Sn1 Pd2\n1.0\n3.884925 0.000000 2.242963\n1.294975 3.662743 2.242963\n0.000000 0.000000 4.485926\nLi Sn Pd\n1 1 2\ndirect\n0.500001 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Sn\n0.250001 0.250000 0.250000 Pd\n0.750002 0.749999 0.749999 Pd\n",
"nsites": 4,
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"formula_full": "Li1 Sn1 Pd2",
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{
"id": "jvasp-5041",
"created_at": "2022-09-04T14:37:06.602649Z",
"updated_at": "2022-09-04T14:37:06.602676Z",
"structure_string": "Li1 Si3 Pd1\n1.0\n3.226915 -0.000000 -1.181126\n-0.432320 3.197824 -1.181126\n0.779840 0.892363 7.129209\nLi Si Pd\n1 3 1\ndirect\n0.603763 0.603762 0.207524 Li\n0.760782 0.260780 0.521561 Si\n0.260781 0.760780 0.521561 Si\n0.413150 0.413149 0.826299 Si\n0.982528 0.982524 0.965051 Pd\n",
"nsites": 5,
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"elements": [
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"formula_full": "Li1 Si3 Pd1",
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"spacegroup": 107
},
{
"id": "jvasp-13764",
"created_at": "2022-09-04T14:35:54.307575Z",
"updated_at": "2022-09-04T14:35:54.307597Z",
"structure_string": "Li1 Si3 Pd1\n1.0\n3.226920 -0.000000 -1.181128\n-0.432321 3.197829 -1.181128\n0.779890 0.892419 7.129352\nLi Si Pd\n1 3 1\ndirect\n0.603763 0.603763 0.207525 Li\n0.760783 0.260783 0.521566 Si\n0.260784 0.760784 0.521566 Si\n0.413150 0.413151 0.826300 Si\n0.982521 0.982522 0.965041 Pd\n",
"nsites": 5,
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},
{
"id": "jvasp-17817",
"created_at": "2022-09-04T14:37:28.597208Z",
"updated_at": "2022-09-04T14:37:28.597230Z",
"structure_string": "Li1 Si3 Pd1\n1.0\n3.226915 -0.000000 -1.181126\n-0.432320 3.197824 -1.181126\n0.779840 0.892363 7.129209\nLi Si Pd\n1 3 1\ndirect\n0.603763 0.603762 0.207524 Li\n0.760782 0.260780 0.521561 Si\n0.260781 0.760780 0.521561 Si\n0.413150 0.413149 0.826299 Si\n0.982528 0.982524 0.965051 Pd\n",
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"formula_full": "Li1 Si3 Pd1",
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},
{
"id": "jvasp-41238",
"created_at": "2022-09-04T14:38:05.685754Z",
"updated_at": "2022-09-04T14:38:05.685781Z",
"structure_string": "Li1 Si1 Pd2\n1.0\n-0.000000 2.980027 2.980027\n2.980027 0.000000 2.980027\n2.980027 2.980027 -0.000000\nLi Si Pd\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Li\n0.750001 0.750001 0.750001 Si\n0.000000 0.000000 0.000000 Pd\n0.500002 0.500002 0.500002 Pd\n",
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{
"id": "jvasp-41379",
"created_at": "2022-09-04T14:37:50.721884Z",
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"structure_string": "Li1 Sc1 Pd2\n1.0\n0.000000 3.167231 3.167231\n3.167231 0.000000 3.167231\n3.167231 3.167231 -0.000000\nLi Sc Pd\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Li\n0.750001 0.750001 0.750001 Sc\n0.000000 0.000000 0.000000 Pd\n0.499999 0.499999 0.499999 Pd\n",
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},
{
"id": "jvasp-105803",
"created_at": "2022-09-04T14:35:57.746760Z",
"updated_at": "2022-09-04T14:35:57.746782Z",
"structure_string": "Li1 Sc2 Pd1\n1.0\n4.058976 0.000000 2.343450\n1.352992 3.826838 2.343450\n0.000000 0.000000 4.686901\nLi Sc Pd\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 Sc\n0.750000 0.750000 0.749999 Sc\n0.000000 0.000000 0.000000 Pd\n",
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{
"id": "jvasp-41726",
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"updated_at": "2022-09-04T14:37:31.363624Z",
"structure_string": "Li1 Sb1 Pd2\n1.0\n-0.000000 3.188328 3.188328\n3.188328 0.000000 3.188328\n3.188328 3.188328 -0.000000\nLi Sb Pd\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Li\n0.750001 0.750001 0.750001 Sb\n0.000000 0.000000 0.000000 Pd\n0.499999 0.499999 0.499999 Pd\n",
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