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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_reduced&page=1277",
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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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{
"id": "jvasp-29712",
"created_at": "2022-09-04T14:38:10.099691Z",
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"structure_string": "Re6 Se8 Cl2\n1.0\n6.281359 0.000149 2.262758\n-0.095783 6.541639 1.541640\n0.024487 0.007454 8.911710\nRe Se Cl\n6 8 2\ndirect\n0.893054 0.754403 0.536674 Re\n0.840683 0.371144 0.718465 Re\n0.159318 0.628856 0.281535 Re\n0.773897 0.462202 0.430397 Re\n0.106947 0.245597 0.463326 Re\n0.226104 0.537798 0.569603 Re\n0.829703 0.828220 0.262699 Se\n0.170298 0.171779 0.737301 Se\n0.523014 0.593304 0.690962 Se\n0.713005 0.100175 0.608145 Se\n0.286996 0.899825 0.391855 Se\n0.476987 0.406695 0.309038 Se\n0.041576 0.338411 0.189330 Se\n0.958425 0.661589 0.810670 Se\n0.358466 0.791515 0.009620 Cl\n0.641535 0.208484 0.990380 Cl\n",
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"formula_anonymous": "AB3C4",
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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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"elements": [
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"chemical_system": "Re-Sb",
"density": 17.16040064519947,
"density_atomic": 0.06075557560784262,
"volume": 65.83757885562129,
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"formula_full": "Re3 Sb1",
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"spacegroup": 225
},
{
"id": "jvasp-98895",
"created_at": "2022-09-04T14:35:54.706894Z",
"updated_at": "2022-09-04T14:35:54.706920Z",
"structure_string": "Re12 S16 Cl4\n1.0\n6.431441 0.028690 0.000000\n-1.764533 9.706998 0.000000\n0.000000 0.000000 11.481762\nRe S Cl\n12 16 4\ndirect\n0.753105 0.067599 0.022259 Re\n0.746895 0.432401 0.522259 Re\n0.253105 0.567599 0.477741 Re\n0.875293 0.833572 0.066035 Re\n0.624708 0.666428 0.566035 Re\n0.592534 0.561847 0.352342 Re\n0.092534 0.061847 0.147658 Re\n0.375292 0.333572 0.433965 Re\n0.124708 0.166428 0.933965 Re\n0.407466 0.438153 0.647658 Re\n0.246896 0.932401 0.977741 Re\n0.907466 0.938153 0.852342 Re\n0.756769 0.529934 0.715948 S\n0.256769 0.029933 0.784052 S\n0.072599 0.334410 0.560536 S\n0.572599 0.834410 0.939463 S\n0.801610 0.161360 0.827204 S\n0.427401 0.165590 0.060537 S\n0.469356 0.773836 0.405998 S\n0.743232 0.970067 0.215948 S\n0.030645 0.726164 0.905998 S\n0.243232 0.470067 0.284052 S\n0.969356 0.273836 0.094002 S\n0.301610 0.661360 0.672795 S\n0.927401 0.665590 0.439463 S\n0.530644 0.226164 0.594002 S\n0.198391 0.838640 0.172795 S\n0.698390 0.338640 0.327205 S\n0.792243 0.892296 0.645686 Cl\n0.707758 0.607704 0.145686 Cl\n0.292243 0.392296 0.854314 Cl\n0.207757 0.107704 0.354314 Cl\n",
"nsites": 32,
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"elements": [
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"S",
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],
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"density": 6.687955107984274,
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"volume": 717.3874864689146,
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"formula_full": "Re12 S16 Cl4",
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"spacegroup": 14
},
{
"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",
"nsites": 4,
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"density": 18.547681595271342,
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"volume": 59.06089511821786,
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"formula_full": "Re3 Ru1",
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"spacegroup": 44
},
{
"id": "jvasp-41916",
"created_at": "2022-09-04T14:37:33.291921Z",
"updated_at": "2022-09-04T14:37:33.291939Z",
"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",
"nsites": 8,
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"density": 20.742865273176623,
"density_atomic": 0.06629461366659578,
"volume": 120.67345380777145,
"volume_molar": 9.08390656032197,
"formula_full": "Re6 Pt2",
"formula_reduced": "Re3Pt",
"formula_anonymous": "AB3",
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"spacegroup": 194
},
{
"id": "jvasp-41914",
"created_at": "2022-09-04T14:37:31.316943Z",
"updated_at": "2022-09-04T14:37:31.316964Z",
"structure_string": "Re6 Pd2\n1.0\n2.786305 -4.826023 0.000000\n2.786305 4.826023 -0.000000\n0.000000 -0.000000 4.446870\nRe Pd\n6 2\ndirect\n0.839573 0.679145 0.750000 Re\n0.839573 0.160429 0.750000 Re\n0.320857 0.160428 0.750000 Re\n0.160428 0.320857 0.250000 Re\n0.160429 0.839573 0.250000 Re\n0.679145 0.839573 0.250000 Re\n0.666668 0.333334 0.250000 Pd\n0.333334 0.666668 0.750000 Pd\n",
"nsites": 8,
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"elements": [
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"chemical_system": "Pd-Re",
"density": 18.468220149910373,
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"volume": 119.5920941408195,
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"formula_full": "Re6 Pd2",
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"spacegroup": 194
},
{
"id": "jvasp-79420",
"created_at": "2022-09-04T14:37:11.660536Z",
"updated_at": "2022-09-04T14:37:11.660562Z",
"structure_string": "Re3 Pb1\n1.0\n0.000000 3.239039 3.239039\n3.239039 0.000000 3.239039\n3.239039 3.239039 0.000000\nRe Pb\n3 1\ndirect\n0.000000 0.000000 0.000000 Re\n0.500000 0.500000 0.500000 Re\n0.250000 0.250000 0.250000 Re\n0.750000 0.750000 0.750000 Pb\n",
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},
{
"id": "jvasp-85846",
"created_at": "2022-09-04T14:36:15.839989Z",
"updated_at": "2022-09-04T14:36:15.840010Z",
"structure_string": "Re3 P4\n1.0\n2.969504 -0.000000 -0.735461\n-0.597260 5.564835 -2.411506\n-0.000457 0.013371 6.360740\nRe P\n3 4\ndirect\n0.263817 0.318756 0.527636 Re\n0.736180 0.681243 0.472363 Re\n0.000000 0.000000 0.000000 Re\n0.086312 0.436131 0.172625 P\n0.913685 0.563868 0.827374 P\n0.352023 0.024926 0.704047 P\n0.647975 0.975073 0.295952 P\n",
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"spacegroup": 12
},
{
"id": "jvasp-86345",
"created_at": "2022-09-04T14:36:00.257695Z",
"updated_at": "2022-09-04T14:36:00.257714Z",
"structure_string": "Re3 P4\n1.0\n2.969510 -0.000000 -0.735462\n-0.597259 5.564867 -2.411499\n-0.000467 0.013364 6.360711\nRe P\n3 4\ndirect\n0.263818 0.318760 0.527638 Re\n0.736180 0.681240 0.472362 Re\n0.000000 0.000000 0.000000 Re\n0.086313 0.436126 0.172627 P\n0.913685 0.563873 0.827373 P\n0.352022 0.024924 0.704044 P\n0.647977 0.975076 0.295956 P\n",
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{
"id": "jvasp-91990",
"created_at": "2022-09-04T14:35:54.981248Z",
"updated_at": "2022-09-04T14:35:54.981267Z",
"structure_string": "Re6 Ni2\n1.0\n5.425589 -0.000002 -0.000000\n-2.712796 4.698688 0.000000\n0.000000 -0.000000 4.380731\nRe Ni\n6 2\ndirect\n0.833252 0.166748 0.749999 Re\n0.333499 0.166749 0.749999 Re\n0.833252 0.666503 0.749999 Re\n0.166748 0.833252 0.250000 Re\n0.666504 0.833251 0.250000 Re\n0.166748 0.333496 0.250000 Re\n0.666666 0.333331 0.250000 Ni\n0.333335 0.666667 0.749999 Ni\n",
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},
{
"id": "jvasp-39476",
"created_at": "2022-09-04T14:37:52.483823Z",
"updated_at": "2022-09-04T14:37:52.483841Z",
"structure_string": "Re3 N1\n1.0\n1.420337 -2.460095 0.000000\n1.420337 2.460095 -0.000000\n-0.000000 0.000000 7.200161\nRe N\n3 1\ndirect\n0.666668 0.333334 0.801165 Re\n0.666668 0.333334 0.198835 Re\n0.333334 0.666668 0.500000 Re\n0.333334 0.666668 0.000000 N\n",
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}
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}