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{
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{
"id": "jvasp-104660",
"created_at": "2022-09-04T14:36:59.028832Z",
"updated_at": "2022-09-04T14:36:59.028849Z",
"structure_string": "Sm2 Sb2 Pd2\n1.0\n4.640882 -0.000000 0.000000\n-2.320440 4.019122 0.000000\n-0.000000 -0.000000 7.566088\nSm Sb Pd\n2 2 2\ndirect\n0.000000 0.000000 0.985004 Sm\n0.000000 0.000000 0.485004 Sm\n0.666666 0.333333 0.712511 Sb\n0.333333 0.666666 0.212511 Sb\n0.666666 0.333333 0.311486 Pd\n0.333333 0.666666 0.811486 Pd\n",
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{
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{
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"structure_string": "Sr2 Sb4 Pd4\n1.0\n4.720009 -0.000000 -0.000000\n0.000000 4.720009 0.000000\n0.000000 -0.000000 10.731142\nSr Sb Pd\n2 4 4\ndirect\n0.250000 0.250000 0.759302 Sr\n0.750000 0.750000 0.240698 Sr\n0.750000 0.250000 0.500000 Sb\n0.250000 0.750000 0.500000 Sb\n0.250000 0.250000 0.125652 Sb\n0.750000 0.750000 0.874348 Sb\n0.750000 0.250000 0.000000 Pd\n0.250000 0.750000 0.000000 Pd\n0.250000 0.250000 0.371853 Pd\n0.750000 0.750000 0.628147 Pd\n",
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"volume": 239.07358565149357,
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"formula_full": "Sr2 Sb4 Pd4",
"formula_reduced": "Sr(SbPd)2",
"formula_anonymous": "AB2C2",
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"spacegroup": 129
},
{
"id": "jvasp-107002",
"created_at": "2022-09-04T14:36:47.554474Z",
"updated_at": "2022-09-04T14:36:47.554495Z",
"structure_string": "Tb2 Sb2 Pd2\n1.0\n4.604699 0.000000 0.000000\n-2.302349 3.987787 0.000000\n0.000000 0.000000 7.448621\nTb Sb Pd\n2 2 2\ndirect\n0.000000 0.000000 0.982532 Tb\n0.000000 0.000000 0.482532 Tb\n0.666667 0.333334 0.709673 Sb\n0.333333 0.666667 0.209673 Sb\n0.666667 0.333334 0.316794 Pd\n0.333333 0.666667 0.816794 Pd\n",
"nsites": 6,
"nelements": 3,
"elements": [
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],
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"volume": 136.77574117419132,
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"formula_full": "Tb2 Sb2 Pd2",
"formula_reduced": "TbSbPd",
"formula_anonymous": "ABC",
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"spacegroup": 186
},
{
"id": "jvasp-90632",
"created_at": "2022-09-04T14:36:01.609148Z",
"updated_at": "2022-09-04T14:36:01.609184Z",
"structure_string": "Tb2 Sb4 Pd2\n1.0\n4.459052 0.000000 0.000000\n-0.000000 4.459052 -0.000000\n-0.000000 0.000000 9.539497\nTb Sb Pd\n2 4 2\ndirect\n0.750000 0.750000 0.744079 Tb\n0.250000 0.250000 0.255922 Tb\n0.250000 0.750000 0.000000 Sb\n0.750000 0.250000 0.000000 Sb\n0.750000 0.750000 0.334512 Sb\n0.250000 0.250000 0.665489 Sb\n0.250000 0.750000 0.500000 Pd\n0.750000 0.250000 0.500000 Pd\n",
"nsites": 8,
"nelements": 3,
"elements": [
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],
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"density": 8.909871139305016,
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"volume": 189.67519958543258,
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"formula_full": "Tb2 Sb4 Pd2",
"formula_reduced": "TbSb2Pd",
"formula_anonymous": "ABC2",
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"spacegroup": 129
},
{
"id": "jvasp-35093",
"created_at": "2022-09-04T14:37:34.984850Z",
"updated_at": "2022-09-04T14:37:34.984878Z",
"structure_string": "Tb2 Sb2 Pd2\n1.0\n2.285560 -3.958706 0.000000\n2.285560 3.958706 -0.000000\n-0.000000 -0.000000 7.621185\nTb Sb Pd\n2 2 2\ndirect\n0.000000 0.000000 0.500000 Tb\n0.000000 0.000000 0.000000 Tb\n0.333333 0.666667 0.250000 Sb\n0.666667 0.333333 0.750000 Sb\n0.333333 0.666667 0.750000 Pd\n0.666667 0.333333 0.250000 Pd\n",
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"volume": 137.91083112928868,
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"formula_full": "Tb2 Sb2 Pd2",
"formula_reduced": "TbSbPd",
"formula_anonymous": "ABC",
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"spacegroup": 194
},
{
"id": "jvasp-21629",
"created_at": "2022-09-04T14:38:34.315104Z",
"updated_at": "2022-09-04T14:38:34.315129Z",
"structure_string": "Sb4 Te4 Pd4\n1.0\n6.653619 -0.000000 0.000000\n-0.000000 6.653619 0.000000\n-0.000000 0.000000 6.653619\nSb Te Pd\n4 4 4\ndirect\n0.626873 0.626873 0.626873 Sb\n0.873127 0.373127 0.126873 Sb\n0.126873 0.873127 0.373127 Sb\n0.373127 0.126873 0.873127 Sb\n0.373933 0.373933 0.373933 Te\n0.126067 0.626067 0.873933 Te\n0.873933 0.126067 0.626067 Te\n0.626067 0.873933 0.126067 Te\n0.004631 0.004631 0.004631 Pd\n0.495369 0.995369 0.504631 Pd\n0.504631 0.495369 0.995369 Pd\n0.995369 0.504631 0.495369 Pd\n",
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"elements": [
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"Te",
"Pd"
],
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"density": 8.022631301218702,
"density_atomic": 0.040738727566094556,
"volume": 294.5600100182606,
"volume_molar": 14.782348688308126,
"formula_full": "Sb4 Te4 Pd4",
"formula_reduced": "SbTePd",
"formula_anonymous": "ABC",
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"spacegroup": 198
},
{
"id": "jvasp-100355",
"created_at": "2022-09-04T14:36:41.186835Z",
"updated_at": "2022-09-04T14:36:41.186851Z",
"structure_string": "Sb1 Te1 Pd2\n1.0\n4.185954 0.000000 -0.000000\n-2.092977 3.625143 0.000000\n0.000000 0.000000 5.736742\nSb Te Pd\n1 1 2\ndirect\n0.333332 0.666666 0.500000 Sb\n0.000000 0.000000 0.000000 Te\n0.666666 0.333333 0.255638 Pd\n0.666666 0.333333 0.744362 Pd\n",
"nsites": 4,
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"elements": [
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],
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"density": 8.816457649305445,
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"formula_full": "Sb1 Te1 Pd2",
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"formula_anonymous": "ABC2",
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"spacegroup": 187
},
{
"id": "jvasp-40080",
"created_at": "2022-09-04T14:37:36.601175Z",
"updated_at": "2022-09-04T14:37:36.601186Z",
"structure_string": "Tm1 Sb1 Pd2\n1.0\n-0.000000 3.381883 3.381883\n3.381883 -0.000000 3.381883\n3.381883 3.381883 -0.000000\nTm Sb Pd\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Tm\n0.249999 0.249999 0.249999 Sb\n0.000000 0.000000 0.000000 Pd\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
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"elements": [
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],
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"formula_full": "Tm1 Sb1 Pd2",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-35756",
"created_at": "2022-09-04T14:37:31.139179Z",
"updated_at": "2022-09-04T14:37:31.139201Z",
"structure_string": "Tm1 Sb1 Pd1\n1.0\n3.334051 3.334051 0.000000\n3.334051 -0.000000 -3.334051\n0.000000 3.334051 -3.334051\nTm Sb Pd\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Tm\n0.750000 0.750000 0.750000 Sb\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 3,
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},
{
"id": "jvasp-15336",
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"updated_at": "2022-09-04T14:37:00.390823Z",
"structure_string": "U2 Sb4 Pd2\n1.0\n4.381691 0.000000 0.000000\n0.000000 4.381691 0.000000\n-0.000000 0.000000 9.614710\nU Sb Pd\n2 4 2\ndirect\n0.500000 0.000000 0.746266 U\n0.000000 0.500000 0.253734 U\n0.500000 0.000000 0.321018 Sb\n0.000000 0.500000 0.678982 Sb\n0.500000 0.500000 0.000000 Sb\n0.000000 0.000000 0.000000 Sb\n0.500000 0.500000 0.500000 Pd\n0.000000 0.000000 0.500000 Pd\n",
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{
"id": "jvasp-108919",
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"structure_string": "U2 Sb4 Pd1\n1.0\n4.403756 0.000000 0.000000\n0.000000 4.403756 0.000000\n0.000000 0.000000 9.239766\nU Sb Pd\n2 4 1\ndirect\n0.500000 -0.000000 0.764987 U\n-0.000000 0.500000 0.235013 U\n0.500000 -0.000000 0.165436 Sb\n-0.000000 0.500000 0.834564 Sb\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 -0.000000 Pd\n",
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}
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}