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{
"id": "jvasp-39466",
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"structure_string": "Re6 Tc2\n1.0\n2.779332 -4.813944 0.000000\n2.779332 4.813944 -0.000000\n-0.000000 -0.000000 4.468375\nRe Tc\n6 2\ndirect\n0.833543 0.166456 0.250000 Re\n0.833543 0.667087 0.250000 Re\n0.332912 0.166456 0.250000 Re\n0.166456 0.833543 0.749999 Re\n0.166456 0.332912 0.749999 Re\n0.667087 0.833543 0.749999 Re\n0.666666 0.333333 0.749999 Tc\n0.333333 0.666666 0.250000 Tc\n",
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{
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"structure_string": "Re3 Sn1\n1.0\n-1.979459 1.979459 4.156145\n1.979459 -1.979459 4.156145\n1.979459 1.979459 -4.156145\nRe Sn\n3 1\ndirect\n0.750000 0.249999 0.500000 Re\n0.249999 0.750000 0.500000 Re\n0.500001 0.500001 0.000000 Re\n0.000000 0.000000 0.000000 Sn\n",
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{
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"structure_string": "Re6 Sn2\n1.0\n2.865339 -4.962912 0.000000\n2.865339 4.962912 -0.000000\n-0.000000 -0.000000 4.582061\nRe Sn\n6 2\ndirect\n0.670436 0.835219 0.250000 Re\n0.164782 0.835218 0.250000 Re\n0.164782 0.329564 0.250000 Re\n0.329564 0.164782 0.750000 Re\n0.835218 0.164782 0.750000 Re\n0.835219 0.670436 0.750000 Re\n0.333333 0.666667 0.750000 Sn\n0.666667 0.333333 0.250000 Sn\n",
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{
"id": "jvasp-38147",
"created_at": "2022-09-04T14:38:30.236927Z",
"updated_at": "2022-09-04T14:38:30.236953Z",
"structure_string": "Re1 Sn3\n1.0\n-0.000000 3.527518 3.527518\n3.527518 0.000000 3.527518\n3.527518 3.527518 0.000000\nRe Sn\n1 3\ndirect\n0.750000 0.750000 0.750000 Re\n0.000000 0.000000 0.000000 Sn\n0.499999 0.499999 0.499999 Sn\n0.250000 0.250000 0.250000 Sn\n",
"nsites": 4,
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"elements": [
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"density": 10.2584234178553,
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"volume": 87.78851672228248,
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{
"id": "jvasp-15997",
"created_at": "2022-09-04T14:36:35.067249Z",
"updated_at": "2022-09-04T14:36:35.067279Z",
"structure_string": "Re4 Si4\n1.0\n4.827012 -0.000000 -0.000000\n-0.000000 4.827012 -0.000000\n0.000000 -0.000000 4.827012\nRe Si\n4 4\ndirect\n0.867313 0.632687 0.367313 Re\n0.632687 0.367313 0.867313 Re\n0.367313 0.867313 0.632687 Re\n0.132687 0.132687 0.132687 Re\n0.156324 0.343675 0.656324 Si\n0.343675 0.656324 0.156324 Si\n0.656324 0.156324 0.343675 Si\n0.843675 0.843675 0.843675 Si\n",
"nsites": 8,
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"volume": 112.46959608252925,
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"formula_full": "Re4 Si4",
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"spacegroup": 198
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{
"id": "jvasp-39472",
"created_at": "2022-09-04T14:37:49.628063Z",
"updated_at": "2022-09-04T14:37:49.628081Z",
"structure_string": "Re6 Si2\n1.0\n2.749613 -4.762469 0.000000\n2.749613 4.762469 0.000000\n-0.000000 -0.000000 4.439727\nRe Si\n6 2\ndirect\n0.658896 0.829447 0.750001 Re\n0.170552 0.341103 0.750001 Re\n0.170552 0.829447 0.750001 Re\n0.341103 0.170552 0.250000 Re\n0.829447 0.658896 0.250000 Re\n0.829447 0.170552 0.250000 Re\n0.333332 0.666667 0.250000 Si\n0.666667 0.333332 0.750001 Si\n",
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"spacegroup": 194
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{
"id": "jvasp-600",
"created_at": "2022-09-04T14:37:54.298763Z",
"updated_at": "2022-09-04T14:37:54.298782Z",
"structure_string": "Re4 Se8\n1.0\n6.677944 -0.003009 -0.001699\n-3.280362 5.955637 0.000263\n-1.763156 -1.229723 6.510137\nRe Se\n4 8\ndirect\n0.063956 0.315488 0.491765 Re\n0.936043 0.684513 0.508235 Re\n0.486989 0.290872 0.497068 Re\n0.513010 0.709129 0.502932 Re\n0.247635 0.381391 0.208213 Se\n0.752364 0.618610 0.791787 Se\n0.720731 0.338901 0.241258 Se\n0.279268 0.661099 0.758742 Se\n0.226255 0.109558 0.721784 Se\n0.773745 0.890443 0.278215 Se\n0.754623 0.136450 0.694912 Se\n0.245376 0.863550 0.305088 Se\n",
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"elements": [
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"density": 8.831049564476066,
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"volume": 258.8305379557727,
"volume_molar": 12.989282771301548,
"formula_full": "Re4 Se8",
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"formula_anonymous": "AB2",
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"spacegroup": 2
},
{
"id": "jvasp-39469",
"created_at": "2022-09-04T14:37:51.353753Z",
"updated_at": "2022-09-04T14:37:51.353769Z",
"structure_string": "Re3 Sb1\n1.0\n0.000000 3.204901 3.204901\n3.204901 0.000000 3.204901\n3.204901 3.204901 0.000000\nRe Sb\n3 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.500001 0.500001 0.500001 Re\n0.250000 0.250000 0.250000 Re\n0.750001 0.750001 0.750001 Sb\n",
"nsites": 4,
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"density": 17.16040064519947,
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"volume": 65.83757885562129,
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"formula_full": "Re3 Sb1",
"formula_reduced": "Re3Sb",
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"spacegroup": 225
},
{
"id": "jvasp-41936",
"created_at": "2022-09-04T14:37:40.082371Z",
"updated_at": "2022-09-04T14:37:40.082399Z",
"structure_string": "Re2 Ru6\n1.0\n2.741134 -4.747782 -0.000000\n2.741134 4.747782 0.000000\n0.000000 0.000000 4.333349\nRe Ru\n2 6\ndirect\n0.333332 0.666666 0.250000 Re\n0.666666 0.333332 0.750000 Re\n0.167215 0.832784 0.750000 Ru\n0.665568 0.832784 0.750000 Ru\n0.167215 0.334430 0.750000 Ru\n0.832784 0.167215 0.250000 Ru\n0.334430 0.167215 0.250000 Ru\n0.832784 0.665568 0.250000 Ru\n",
"nsites": 8,
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"density_atomic": 0.07092760372001874,
"volume": 112.79106554310484,
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"formula_full": "Re2 Ru6",
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{
"id": "jvasp-39481",
"created_at": "2022-09-04T14:38:01.524501Z",
"updated_at": "2022-09-04T14:38:01.524523Z",
"structure_string": "Re3 Ru1\n1.0\n-4.428193 1.382999 2.410969\n4.428193 -1.382999 2.410969\n4.428193 1.382999 -2.410969\nRe Ru\n3 1\ndirect\n0.670816 0.170818 0.499999 Re\n0.998911 0.250020 0.251108 Re\n0.998911 0.747802 0.748891 Re\n0.664763 0.664763 -0.000000 Ru\n",
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},
{
"id": "jvasp-40577",
"created_at": "2022-09-04T14:37:53.801950Z",
"updated_at": "2022-09-04T14:37:53.801968Z",
"structure_string": "Re2 Rh6\n1.0\n2.743831 -4.752456 -0.000000\n2.743831 4.752456 0.000000\n0.000000 -0.000000 4.366122\nRe Rh\n2 6\ndirect\n0.666667 0.333333 0.250000 Re\n0.333333 0.666667 0.750000 Re\n0.831349 0.168651 0.750000 Rh\n0.337304 0.168651 0.750000 Rh\n0.831348 0.662696 0.750000 Rh\n0.168651 0.831349 0.250000 Rh\n0.662696 0.831348 0.250000 Rh\n0.168651 0.337304 0.250000 Rh\n",
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{
"id": "jvasp-41916",
"created_at": "2022-09-04T14:37:33.291921Z",
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"structure_string": "Re6 Pt2\n1.0\n2.800123 -4.849955 -0.000000\n2.800123 4.849955 -0.000000\n-0.000000 -0.000000 4.442904\nRe Pt\n6 2\ndirect\n0.840682 0.159317 0.250000 Re\n0.840682 0.681365 0.250000 Re\n0.318634 0.159317 0.250000 Re\n0.159317 0.840682 0.749999 Re\n0.159317 0.318634 0.749999 Re\n0.681365 0.840682 0.749999 Re\n0.666666 0.333333 0.749999 Pt\n0.333333 0.666666 0.250000 Pt\n",
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