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{
"id": "jvasp-102120",
"created_at": "2022-09-04T14:37:01.063874Z",
"updated_at": "2022-09-04T14:37:01.063893Z",
"structure_string": "Pa3 Re1\n1.0\n4.358117 0.000000 2.516161\n1.452706 4.108873 2.516161\n-0.000000 -0.000000 5.032321\nPa Re\n3 1\ndirect\n0.250000 0.250000 0.250000 Pa\n0.750001 0.750000 0.749999 Pa\n0.500001 0.500000 0.499999 Pa\n0.000000 0.000000 0.000000 Re\n",
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{
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"created_at": "2022-09-04T14:37:32.270530Z",
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"structure_string": "Pa1 Zn1 Pt2\n1.0\n-0.000000 3.366197 3.366197\n3.366197 0.000000 3.366197\n3.366197 3.366197 -0.000000\nPa Zn Pt\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Pa\n0.750000 0.750000 0.750000 Zn\n0.000000 0.000000 0.000000 Pt\n0.499999 0.499999 0.499999 Pt\n",
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{
"id": "jvasp-39774",
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"structure_string": "Yb1 Pa1 Pt2\n1.0\n0.000000 3.476676 3.476676\n3.476676 0.000000 3.476676\n3.476676 3.476676 0.000000\nYb Pa Pt\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Yb\n0.249999 0.249999 0.249999 Pa\n0.000000 0.000000 0.000000 Pt\n0.500001 0.500001 0.500001 Pt\n",
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{
"id": "jvasp-42086",
"created_at": "2022-09-04T14:37:39.593864Z",
"updated_at": "2022-09-04T14:37:39.593893Z",
"structure_string": "Pa2 Pt6\n1.0\n2.886436 -4.999453 -0.000000\n2.886436 4.999453 0.000000\n-0.000000 -0.000000 5.093063\nPa Pt\n2 6\ndirect\n0.333334 0.666668 0.250000 Pa\n0.666668 0.333334 0.750000 Pa\n0.668843 0.834422 0.750000 Pt\n0.165580 0.331159 0.750000 Pt\n0.165580 0.834421 0.750000 Pt\n0.331159 0.165580 0.250000 Pt\n0.834422 0.668843 0.250000 Pt\n0.834421 0.165580 0.250000 Pt\n",
"nsites": 8,
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"elements": [
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"density": 18.442889959146548,
"density_atomic": 0.054424759751941,
"volume": 146.99192125904955,
"volume_molar": 11.065075505060411,
"formula_full": "Pa2 Pt6",
"formula_reduced": "PaPt3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.891574325,
"spacegroup": 194
},
{
"id": "jvasp-93913",
"created_at": "2022-09-04T14:35:57.077656Z",
"updated_at": "2022-09-04T14:35:57.077688Z",
"structure_string": "Pa1 Pt5\n1.0\n-3.761202 -3.761202 -0.000000\n-3.761202 0.000000 -3.761202\n0.000000 -3.761202 -3.761202\nPa Pt\n1 5\ndirect\n0.000000 0.000000 0.000000 Pa\n0.750000 0.750000 0.750000 Pt\n0.873687 0.375437 0.375437 Pt\n0.375437 0.873687 0.375437 Pt\n0.375437 0.375437 0.873687 Pt\n0.375437 0.375437 0.375437 Pt\n",
"nsites": 6,
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"elements": [
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"chemical_system": "Pa-Pt",
"density": 18.825675615659705,
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"volume": 106.41674496945154,
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"formula_full": "Pa1 Pt5",
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"spacegroup": 216
},
{
"id": "jvasp-109583",
"created_at": "2022-09-04T14:38:20.369339Z",
"updated_at": "2022-09-04T14:38:20.369356Z",
"structure_string": "Pm3 Pa1\n1.0\n4.536619 0.026718 -4.161312\n-0.859416 4.454552 -4.161312\n-0.021924 -0.026718 6.156049\nPm Pa\n3 1\ndirect\n0.750000 0.250000 0.500001 Pm\n0.250000 0.750000 0.500000 Pm\n0.500000 0.500000 0.000000 Pm\n0.000000 0.000000 0.000000 Pa\n",
"nsites": 4,
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"elements": [
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"density": 8.95220330836459,
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"volume": 123.54261408070637,
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"spacegroup": 139
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{
"id": "jvasp-110018",
"created_at": "2022-09-04T14:37:54.696239Z",
"updated_at": "2022-09-04T14:37:54.696265Z",
"structure_string": "Pa1 Te2 Pd1\n1.0\n4.483221 0.000000 2.588389\n1.494407 4.226821 2.588389\n0.000000 0.000000 5.176778\nPa Te Pd\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Pa\n0.250000 0.250000 0.250000 Te\n0.750000 0.750000 0.750001 Te\n0.000000 0.000000 0.000000 Pd\n",
"nsites": 4,
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"elements": [
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{
"id": "jvasp-42064",
"created_at": "2022-09-04T14:38:18.429698Z",
"updated_at": "2022-09-04T14:38:18.429725Z",
"structure_string": "Pa1 Sn1 Pd2\n1.0\n-0.000008 3.434342 3.434340\n3.434345 -0.000009 3.434341\n3.434343 3.434342 -0.000008\nPa Sn Pd\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Pa\n0.749998 0.749999 0.749999 Sn\n0.000000 0.000000 0.000000 Pd\n0.499999 0.500000 0.500000 Pd\n",
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"elements": [
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"formula_full": "Pa1 Sn1 Pd2",
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{
"id": "jvasp-42083",
"created_at": "2022-09-04T14:37:36.693520Z",
"updated_at": "2022-09-04T14:37:36.693558Z",
"structure_string": "Pa2 Pd6\n1.0\n2.865851 -4.963799 -0.000000\n2.865851 4.963799 0.000000\n-0.000000 0.000000 5.064451\nPa Pd\n2 6\ndirect\n0.666667 0.333333 0.750000 Pa\n0.333333 0.666667 0.250000 Pa\n0.835350 0.164650 0.250000 Pd\n0.835350 0.670700 0.250000 Pd\n0.329300 0.164650 0.250000 Pd\n0.164650 0.835350 0.750000 Pd\n0.164650 0.329300 0.750000 Pd\n0.670700 0.835350 0.750000 Pd\n",
"nsites": 8,
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"formula_full": "Pa2 Pd6",
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"spacegroup": 194
},
{
"id": "jvasp-16330",
"created_at": "2022-09-04T14:37:50.250779Z",
"updated_at": "2022-09-04T14:37:50.250806Z",
"structure_string": "Pa1\n1.0\n2.879607 -0.000000 1.662542\n0.959869 2.714920 1.662542\n0.000000 0.000000 3.325083\nPa\n1\ndirect\n0.000000 0.000000 0.000000 Pa\n",
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{
"id": "jvasp-958",
"created_at": "2022-09-04T14:37:49.321998Z",
"updated_at": "2022-09-04T14:37:49.322021Z",
"structure_string": "Pa1\n1.0\n2.879576 -0.000000 1.662524\n0.959858 2.714890 1.662524\n-0.000000 -0.000000 3.325048\nPa\n1\ndirect\n0.000000 -0.000000 -0.000000 Pa\n",
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{
"id": "jvasp-25284",
"created_at": "2022-09-04T14:37:45.303813Z",
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"structure_string": "Pa1\n1.0\n3.132700 -0.019804 -0.809437\n-1.882932 2.503751 -0.809437\n0.009964 0.019804 3.235568\nPa\n1\ndirect\n0.000000 0.000000 0.000000 Pa\n",
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