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{
"id": "jvasp-80901",
"created_at": "2022-09-04T14:37:19.075477Z",
"updated_at": "2022-09-04T14:37:19.075504Z",
"structure_string": "Ag1 Sb1 Pd2\n1.0\n-10.285045 -3.830998 -2.905298\n-7.679160 -2.260033 0.592256\n-4.516167 1.035995 -0.179360\nAg Sb Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 -0.000000 -0.000000 Sb\n0.750034 -0.000058 -0.000020 Pd\n0.249967 0.000058 0.000020 Pd\n",
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{
"id": "jvasp-102455",
"created_at": "2022-09-04T14:36:47.178138Z",
"updated_at": "2022-09-04T14:36:47.178164Z",
"structure_string": "Ag1 Pd1\n1.0\n2.832808 -0.000000 0.000000\n-1.416404 2.453283 0.000000\n-0.000000 0.000000 4.691910\nAg Pd\n1 1\ndirect\n0.000000 0.000000 0.500000 Ag\n0.666667 0.333333 -0.000000 Pd\n",
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{
"id": "jvasp-104976",
"created_at": "2022-09-04T14:36:52.755475Z",
"updated_at": "2022-09-04T14:36:52.755493Z",
"structure_string": "Ag1 Pd1\n1.0\n2.730725 0.007314 4.109336\n1.246293 2.429746 4.109336\n0.011935 0.007314 4.933899\nAg Pd\n1 1\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.499999 0.500002 Pd\n",
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},
{
"id": "jvasp-79137",
"created_at": "2022-09-04T14:37:10.437884Z",
"updated_at": "2022-09-04T14:37:10.437915Z",
"structure_string": "Ag3 Pd1\n1.0\n-2.053055 2.053055 4.004570\n2.053055 -2.053055 4.004570\n2.053055 2.053055 -4.004570\nAg Pd\n3 1\ndirect\n0.749999 0.250000 0.499999 Ag\n0.250000 0.749999 0.499999 Ag\n0.500001 0.500001 0.000000 Ag\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
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"elements": [
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"volume": 67.5176081651477,
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"formula_full": "Ag3 Pd1",
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"formula_anonymous": "AB3",
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"spacegroup": 139
},
{
"id": "jvasp-108610",
"created_at": "2022-09-04T14:38:27.830129Z",
"updated_at": "2022-09-04T14:38:27.830153Z",
"structure_string": "Ag6 Pd2\n1.0\n5.761391 0.000000 0.000000\n-2.880696 4.989511 0.000000\n-0.000000 -0.000000 4.714518\nAg Pd\n6 2\ndirect\n0.832118 0.167882 0.750000 Ag\n0.335765 0.167882 0.750000 Ag\n0.832117 0.664235 0.750000 Ag\n0.167881 0.832118 0.250000 Ag\n0.664234 0.832118 0.250000 Ag\n0.167882 0.335765 0.250000 Ag\n0.666666 0.333333 0.250000 Pd\n0.333333 0.666667 0.750000 Pd\n",
"nsites": 8,
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"elements": [
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],
"chemical_system": "Ag-Pd",
"density": 10.5377953771211,
"density_atomic": 0.05902926212410266,
"volume": 135.52600375015467,
"volume_molar": 10.20195839029649,
"formula_full": "Ag6 Pd2",
"formula_reduced": "Ag3Pd",
"formula_anonymous": "AB3",
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"spacegroup": 194
},
{
"id": "jvasp-79991",
"created_at": "2022-09-04T14:37:18.514850Z",
"updated_at": "2022-09-04T14:37:18.514870Z",
"structure_string": "Yb2 Ag1 Pb1\n1.0\n-0.000000 3.716121 3.716121\n3.716121 -0.000000 3.716121\n3.716121 3.716121 0.000000\nYb Ag Pb\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.499999 0.499999 0.499999 Yb\n0.250000 0.250000 0.250000 Ag\n0.750000 0.750000 0.750000 Pb\n",
"nsites": 4,
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"Pb"
],
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"density_atomic": 0.038972696553991285,
"volume": 102.63595680269526,
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"formula_full": "Yb2 Ag1 Pb1",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-110885",
"created_at": "2022-09-04T14:38:49.545620Z",
"updated_at": "2022-09-04T14:38:49.545638Z",
"structure_string": "Yb1 Ag2 Pb1\n1.0\n4.349216 -0.000000 2.511021\n1.449739 4.100480 2.511021\n-0.000000 -0.000000 5.022042\nYb Ag Pb\n1 2 1\ndirect\n0.000000 0.000000 0.000000 Yb\n0.750001 0.750000 0.749999 Ag\n0.250000 0.250000 0.250000 Ag\n0.500001 0.500000 0.499999 Pb\n",
"nsites": 4,
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],
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"volume": 89.56246035199636,
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"formula_full": "Yb1 Ag2 Pb1",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
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{
"id": "jvasp-18119",
"created_at": "2022-09-04T14:38:09.400215Z",
"updated_at": "2022-09-04T14:38:09.400242Z",
"structure_string": "Y3 Ag3 Pb3\n1.0\n3.789170 -6.563036 0.000000\n3.789170 6.563036 0.000000\n-0.000000 0.000000 4.473695\nY Ag Pb\n3 3 3\ndirect\n-0.000000 0.421180 0.500001 Y\n0.578820 0.578820 0.500001 Y\n0.421180 -0.000000 0.500001 Y\n-0.000000 0.749169 0.000000 Ag\n0.250831 0.250831 0.000000 Ag\n0.749169 -0.000000 0.000000 Ag\n0.000000 0.000000 0.500001 Pb\n0.333333 0.666667 0.000000 Pb\n0.666667 0.333333 0.000000 Pb\n",
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"Ag",
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],
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"density": 9.044375314588315,
"density_atomic": 0.040448019804397765,
"volume": 222.5078024467705,
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"formula_full": "Y3 Ag3 Pb3",
"formula_reduced": "YAgPb",
"formula_anonymous": "ABC",
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"spacegroup": 189
},
{
"id": "jvasp-17734",
"created_at": "2022-09-04T14:38:14.949387Z",
"updated_at": "2022-09-04T14:38:14.949406Z",
"structure_string": "Tm3 Ag3 Pb3\n1.0\n3.746325 -6.488824 -0.000000\n3.746325 6.488824 0.000000\n-0.000000 0.000000 4.452145\nTm Ag Pb\n3 3 3\ndirect\n-0.000000 0.424626 0.499999 Tm\n0.575373 0.575373 0.499999 Tm\n0.424626 -0.000000 0.499999 Tm\n0.250263 0.250263 0.000000 Ag\n0.749736 -0.000000 0.000000 Ag\n-0.000000 0.749736 0.000000 Ag\n0.000000 0.000000 0.499999 Pb\n0.333332 0.666666 0.000000 Pb\n0.666666 0.333332 0.000000 Pb\n",
"nsites": 9,
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"elements": [
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],
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"density_atomic": 0.04157878250959031,
"volume": 216.45655444394302,
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"formula_full": "Tm3 Ag3 Pb3",
"formula_reduced": "TmAgPb",
"formula_anonymous": "ABC",
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"spacegroup": 189
},
{
"id": "jvasp-18861",
"created_at": "2022-09-04T14:36:57.712728Z",
"updated_at": "2022-09-04T14:36:57.712754Z",
"structure_string": "Tb2 Ag2 Pb2\n1.0\n2.399980 -4.156887 0.000000\n2.399980 4.156887 -0.000000\n-0.000000 0.000000 7.503881\nTb Ag Pb\n2 2 2\ndirect\n0.000000 0.000000 0.997245 Tb\n0.000000 0.000000 0.497245 Tb\n0.666667 0.333333 0.680474 Ag\n0.333333 0.666667 0.180474 Ag\n0.333333 0.666667 0.777080 Pb\n0.666667 0.333333 0.277080 Pb\n",
"nsites": 6,
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},
{
"id": "jvasp-91497",
"created_at": "2022-09-04T14:35:43.425085Z",
"updated_at": "2022-09-04T14:35:43.425111Z",
"structure_string": "Ag4 Sb4 Pb4 S12\n1.0\n5.999341 0.043592 0.000000\n-0.243523 7.685208 0.000000\n0.000000 0.000000 12.795199\nAg Sb Pb S\n4 4 4 12\ndirect\n0.224889 0.883921 0.741598 Ag\n0.775111 0.116079 0.258402 Ag\n0.775111 0.616079 0.241598 Ag\n0.224889 0.383921 0.758402 Ag\n0.735219 0.635373 0.911481 Sb\n0.264781 0.864627 0.411480 Sb\n0.264781 0.364627 0.088520 Sb\n0.735219 0.135373 0.588520 Sb\n0.251802 0.853710 0.082847 Pb\n0.251802 0.353709 0.417153 Pb\n0.748199 0.646291 0.582847 Pb\n0.748198 0.146290 0.917153 Pb\n0.856741 0.360313 0.125339 S\n0.260605 0.648755 0.560354 S\n0.143259 0.139687 0.625339 S\n0.260604 0.148755 0.939646 S\n0.739396 0.351245 0.439646 S\n0.143259 0.639687 0.874661 S\n0.856741 0.860313 0.374661 S\n0.739396 0.851245 0.060354 S\n0.340210 0.637245 0.277251 S\n0.340210 0.137245 0.222749 S\n0.659790 0.862755 0.777251 S\n0.659790 0.362755 0.722749 S\n",
"nsites": 24,
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"formula_anonymous": "ABCD3",
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{
"id": "jvasp-107368",
"created_at": "2022-09-04T14:37:01.662515Z",
"updated_at": "2022-09-04T14:37:01.662537Z",
"structure_string": "Ag1 Sb1 Pb2 S4\n1.0\n5.250770 -0.044025 -4.932045\n-1.012590 5.152396 -4.932045\n0.036526 0.044025 7.203771\nAg Sb Pb S\n1 1 2 4\ndirect\n0.000000 0.000000 0.000000 Ag\n0.500000 0.500000 0.000001 Sb\n0.250001 0.750001 0.500001 Pb\n0.750000 0.250000 0.500001 Pb\n0.000001 0.500001 0.500001 S\n0.269514 0.269514 0.000000 S\n0.500000 -0.000000 0.500000 S\n0.730486 0.730486 0.000001 S\n",
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