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{
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"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=elements&page=3447",
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"results": [
{
"id": "jvasp-86204",
"created_at": "2022-09-04T14:35:40.781539Z",
"updated_at": "2022-09-04T14:35:40.781549Z",
"structure_string": "Tb10 Sb2 Au4\n1.0\n6.553416 -0.000000 -3.386787\n-1.750282 6.315360 -3.386787\n0.994105 1.307090 9.957397\nTb Sb Au\n10 2 4\ndirect\n0.996968 0.496967 0.667468 Tb\n0.003034 0.503033 0.332532 Tb\n0.503034 0.329498 0.332532 Tb\n0.829499 0.003033 0.332532 Tb\n0.496967 0.670502 0.667468 Tb\n0.670503 0.170502 0.667468 Tb\n0.170502 0.996967 0.667468 Tb\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 -0.000000 Tb\n0.329499 0.829498 0.332532 Tb\n0.750001 0.750000 0.500000 Sb\n0.250001 0.250000 0.500000 Sb\n0.127847 0.627847 -0.000000 Au\n0.372153 0.127847 -0.000000 Au\n0.627848 0.872153 -0.000000 Au\n0.872154 0.372153 -0.000000 Au\n",
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"formula_full": "Tb10 Sb2 Au4",
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{
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"created_at": "2022-09-04T14:36:33.449682Z",
"updated_at": "2022-09-04T14:36:33.449704Z",
"structure_string": "Tb2 Sb1 O2\n1.0\n-1.931987 1.931987 6.651223\n1.931987 -1.931987 6.651223\n1.931987 1.931987 -6.651223\nTb Sb O\n2 1 2\ndirect\n0.335457 0.335457 0.000000 Tb\n0.664542 0.664542 0.000000 Tb\n0.000000 0.000000 0.000000 Sb\n0.750001 0.250000 0.500001 O\n0.250000 0.750001 0.500001 O\n",
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"spacegroup": 139
},
{
"id": "jvasp-46038",
"created_at": "2022-09-04T14:38:10.642184Z",
"updated_at": "2022-09-04T14:38:10.642208Z",
"structure_string": "Tb6 Sb2 O14\n1.0\n5.296429 3.708484 0.000000\n-5.296429 3.708484 0.000000\n0.000000 -0.000000 7.519291\nTb Sb O\n6 2 14\ndirect\n0.057131 0.514493 0.250000 Tb\n0.485506 0.942868 0.750000 Tb\n0.000000 0.000000 0.000000 Tb\n0.000000 0.000000 0.500000 Tb\n0.942868 0.485506 0.750000 Tb\n0.514493 0.057131 0.250000 Tb\n0.499999 0.499999 0.500000 Sb\n0.499999 0.499999 0.000000 Sb\n0.437104 0.178809 0.965317 O\n0.821190 0.562895 0.465317 O\n0.437104 0.178809 0.534683 O\n0.821190 0.562895 0.034683 O\n0.409690 0.409690 0.250000 O\n0.590309 0.590309 0.750000 O\n0.178809 0.437104 0.534683 O\n0.562895 0.821190 0.465317 O\n0.562895 0.821190 0.034683 O\n0.848216 0.114652 0.750000 O\n0.151783 0.885347 0.250000 O\n0.114652 0.848216 0.750000 O\n0.178809 0.437104 0.965317 O\n0.885347 0.151783 0.250000 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
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"density": 7.98870144008349,
"density_atomic": 0.07447941008733845,
"volume": 295.3836499806007,
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"formula_full": "Tb6 Sb2 O14",
"formula_reduced": "Tb3SbO7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.216871436363636,
"spacegroup": 63
},
{
"id": "jvasp-40484",
"created_at": "2022-09-04T14:38:05.282622Z",
"updated_at": "2022-09-04T14:38:05.282646Z",
"structure_string": "Tb6 Sb2 O14\n1.0\n-6.440623 -0.004211 0.002885\n0.919255 6.417258 0.001089\n-0.025472 -2.213333 -7.253344\nTb Sb O\n6 2 14\ndirect\n0.734735 0.463996 0.116987 Tb\n0.739411 0.475872 0.614873 Tb\n0.540641 0.995243 0.747894 Tb\n0.459358 0.004758 0.252106 Tb\n0.260588 0.524129 0.385127 Tb\n0.265263 0.536005 0.883013 Tb\n0.000000 0.000000 0.000000 Sb\n-0.000000 0.000000 0.500000 Sb\n0.291295 0.932968 0.953134 O\n0.071138 0.331911 0.613124 O\n0.100900 0.073448 0.269066 O\n0.441660 0.646356 0.166353 O\n0.452402 0.637980 0.655701 O\n0.547597 0.362021 0.344299 O\n0.708704 0.067033 0.046866 O\n0.899098 0.926553 0.730934 O\n0.928861 0.668090 0.386876 O\n0.075041 0.321285 0.044483 O\n0.924958 0.678716 0.955517 O\n0.711043 0.065242 0.484348 O\n0.558338 0.353645 0.833647 O\n0.288955 0.934759 0.515652 O\n",
"nsites": 22,
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"elements": [
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"chemical_system": "O-Sb-Tb",
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"density_atomic": 0.07339695067876316,
"volume": 299.73997279924504,
"volume_molar": 8.204892307252841,
"formula_full": "Tb6 Sb2 O14",
"formula_reduced": "Tb3SbO7",
"formula_anonymous": "AB3C7",
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"spacegroup": 2
},
{
"id": "jvasp-50087",
"created_at": "2022-09-04T14:37:06.471777Z",
"updated_at": "2022-09-04T14:37:06.471801Z",
"structure_string": "Tb6 Sb2 O14\n1.0\n5.297648 3.742996 0.000000\n-5.297648 3.742996 0.000000\n0.000000 0.000000 7.540564\nTb Sb O\n6 2 14\ndirect\n0.000077 0.467655 0.500020 Tb\n0.532346 -0.000076 0.499980 Tb\n0.500031 0.500031 0.750000 Tb\n0.499970 0.499970 0.250000 Tb\n-0.000076 0.532346 0.000020 Tb\n0.467655 0.000077 -0.000020 Tb\n0.000006 0.000006 0.250000 Sb\n-0.000006 -0.000006 0.750000 Sb\n0.321761 0.072871 0.279959 O\n0.927130 0.678240 0.720040 O\n0.630172 0.369829 0.000000 O\n0.927182 0.678277 0.279997 O\n0.321724 0.072819 0.720002 O\n0.072819 0.321724 0.779997 O\n0.072871 0.321761 0.220040 O\n0.369829 0.630172 0.500000 O\n0.678240 0.927130 0.779959 O\n0.636470 0.363532 0.500000 O\n0.363532 0.636470 0.000000 O\n0.070006 0.929995 0.000000 O\n0.678277 0.927182 0.220002 O\n0.929995 0.070006 0.500000 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
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"Sb",
"O"
],
"chemical_system": "O-Sb-Tb",
"density": 7.8908966611461215,
"density_atomic": 0.07356756699323708,
"volume": 299.0448223199011,
"volume_molar": 8.185863697998336,
"formula_full": "Tb6 Sb2 O14",
"formula_reduced": "Tb3SbO7",
"formula_anonymous": "AB3C7",
"energy_above_hull": 2.2150359818181817,
"spacegroup": 63
},
{
"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",
"nsites": 6,
"nelements": 3,
"elements": [
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"Sb",
"Pd"
],
"chemical_system": "Pd-Sb-Tb",
"density": 9.322017006224126,
"density_atomic": 0.04350637256601781,
"volume": 137.91083112928868,
"volume_molar": 13.841973956486102,
"formula_full": "Tb2 Sb2 Pd2",
"formula_reduced": "TbSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0562367333333338,
"spacegroup": 194
},
{
"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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"Pd"
],
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"density_atomic": 0.0438674281600761,
"volume": 136.77574117419132,
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"formula_full": "Tb2 Sb2 Pd2",
"formula_reduced": "TbSbPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0329600666666672,
"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,
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"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",
"energy_above_hull": 1.378066575,
"spacegroup": 129
},
{
"id": "jvasp-112572",
"created_at": "2022-09-04T14:38:42.315305Z",
"updated_at": "2022-09-04T14:38:42.315326Z",
"structure_string": "Tb10 Sb2 Pt4\n1.0\n6.948752 -0.091648 -5.221729\n-1.786627 6.715767 -5.221729\n0.071420 0.091648 8.691750\nTb Sb Pt\n10 2 4\ndirect\n0.000000 0.000000 0.000000 Tb\n0.500000 0.500000 -0.000000 Tb\n0.795694 0.295695 0.812383 Tb\n0.204305 0.704306 0.187616 Tb\n0.483311 0.983312 0.187616 Tb\n0.295694 0.483312 0.500000 Tb\n0.016688 0.204306 0.500000 Tb\n0.516688 0.016688 0.812384 Tb\n0.704305 0.516688 0.500000 Tb\n0.983311 0.795695 0.500000 Tb\n0.250000 0.250000 -0.000000 Sb\n0.749999 0.750000 -0.000000 Sb\n0.139319 0.639320 0.778638 Pt\n0.860681 0.360681 0.221362 Pt\n0.639318 0.860681 0.500000 Pt\n0.360681 0.139319 0.500000 Pt\n",
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"elements": [
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],
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"density": 10.559984663645855,
"density_atomic": 0.03893826207582543,
"volume": 410.9068855934764,
"volume_molar": 15.465869401857066,
"formula_full": "Tb10 Sb2 Pt4",
"formula_reduced": "Tb5SbPt2",
"formula_anonymous": "AB2C5",
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"spacegroup": 140
},
{
"id": "jvasp-7823",
"created_at": "2022-09-04T14:36:46.115951Z",
"updated_at": "2022-09-04T14:36:46.115977Z",
"structure_string": "Tb1 Sb1 Pt1\n1.0\n4.058639 0.000000 2.343256\n1.352879 3.826521 2.343256\n0.000000 0.000000 4.686513\nTb Sb Pt\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Sb\n0.250000 0.250000 0.250000 Pt\n",
"nsites": 3,
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"formula_full": "Tb1 Sb1 Pt1",
"formula_reduced": "TbSbPt",
"formula_anonymous": "ABC",
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"spacegroup": 216
},
{
"id": "jvasp-120609",
"created_at": "2022-09-04T14:38:53.528116Z",
"updated_at": "2022-09-04T14:38:53.528132Z",
"structure_string": "Tb4 Sb6 Rh7\n1.0\n7.183375 -0.000000 -2.539707\n-3.591688 6.220985 -2.539707\n-0.000000 -0.000000 7.619120\nTb Sb Rh\n4 6 7\ndirect\n0.500000 0.000000 -0.000000 Tb\n0.000000 0.500000 -0.000000 Tb\n0.000000 0.000000 0.500000 Tb\n0.500000 0.500000 0.500000 Tb\n0.316394 0.316394 -0.000000 Sb\n0.000000 0.683607 0.683606 Sb\n0.316394 0.000000 0.316394 Sb\n0.683607 0.000000 0.683606 Sb\n0.000000 0.316394 0.316394 Sb\n0.683607 0.683607 -0.000000 Sb\n0.500000 0.250000 0.750000 Rh\n0.000000 0.000000 0.000000 Rh\n0.500000 0.750001 0.250000 Rh\n0.750001 0.500000 0.250000 Rh\n0.250000 0.750001 0.500000 Rh\n0.250000 0.500000 0.750000 Rh\n0.750001 0.250000 0.500000 Rh\n",
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"formula_full": "Tb4 Sb6 Rh7",
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"spacegroup": 229
},
{
"id": "jvasp-87180",
"created_at": "2022-09-04T14:35:51.564642Z",
"updated_at": "2022-09-04T14:35:51.564669Z",
"structure_string": "Tb4 Sb4 Rh4\n1.0\n4.578438 -0.000000 0.000000\n0.000000 7.177275 0.000000\n0.000000 0.000000 7.846304\nTb Sb Rh\n4 4 4\ndirect\n0.250000 0.509510 0.799412 Tb\n0.750000 0.490489 0.200588 Tb\n0.250000 0.009510 0.700588 Tb\n0.750000 0.990489 0.299412 Tb\n0.250000 0.192959 0.091116 Sb\n0.750000 0.307041 0.591116 Sb\n0.250000 0.692958 0.408883 Sb\n0.750000 0.807041 0.908883 Sb\n0.750000 0.199321 0.918360 Rh\n0.250000 0.300679 0.418360 Rh\n0.750000 0.699320 0.581639 Rh\n0.250000 0.800679 0.081639 Rh\n",
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],
"chemical_system": "Rh-Sb-Tb",
"density": 9.881782100766738,
"density_atomic": 0.04654137302104391,
"volume": 257.83510930316004,
"volume_molar": 12.93932767578013,
"formula_full": "Tb4 Sb4 Rh4",
"formula_reduced": "TbSbRh",
"formula_anonymous": "ABC",
"energy_above_hull": 1.4271691666666666,
"spacegroup": 62
}
]
}