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{
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"results": [
{
"id": "jvasp-1720",
"created_at": "2022-09-04T14:36:02.452566Z",
"updated_at": "2022-09-04T14:36:02.452595Z",
"structure_string": "Rb1 Ho1 Se2\n1.0\n4.058843 0.003290 7.210599\n1.892531 3.590619 7.210599\n0.005447 0.003290 8.274474\nRb Ho Se\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500000 0.500000 0.500000 Ho\n0.232303 0.232303 0.232303 Se\n0.767697 0.767697 0.767697 Se\n",
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"elements": [
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"Ho",
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{
"id": "jvasp-88825",
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"updated_at": "2022-09-04T14:35:44.735879Z",
"structure_string": "Rb4 H4 Se4 O16\n1.0\n12.917694 0.000000 0.000000\n0.000000 4.605837 0.000000\n0.000000 0.000000 7.478999\nRb H Se O\n4 4 4 16\ndirect\n0.877846 0.817838 0.452278 Rb\n0.622154 0.182162 0.952278 Rb\n0.377846 0.682163 0.547722 Rb\n0.122154 0.317838 0.047722 Rb\n0.886211 0.272730 0.825492 H\n0.613788 0.727270 0.325492 H\n0.386211 0.227270 0.174508 H\n0.113788 0.772730 0.674508 H\n0.124891 0.226068 0.535870 Se\n0.375109 0.773933 0.035870 Se\n0.624891 0.273932 0.464130 Se\n0.875109 0.726068 0.964130 Se\n0.571354 0.536364 0.318170 O\n0.928645 0.463637 0.818170 O\n0.172508 0.481005 0.672157 O\n0.327492 0.518995 0.172157 O\n0.672508 0.018995 0.327843 O\n0.827492 0.981006 0.827843 O\n0.025945 0.341999 0.416305 O\n0.716389 0.429301 0.583780 O\n0.525944 0.158001 0.583696 O\n0.974055 0.841999 0.083696 O\n0.216389 0.070699 0.416220 O\n0.283611 0.929301 0.916220 O\n0.428646 0.036364 0.181830 O\n0.783611 0.570700 0.083780 O\n0.474055 0.658002 0.916305 O\n0.071354 0.963637 0.681830 O\n",
"nsites": 28,
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],
"chemical_system": "H-O-Rb-Se",
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"density_atomic": 0.06292467763813037,
"volume": 444.97645519971456,
"volume_molar": 9.570395886066125,
"formula_full": "Rb4 H4 Se4 O16",
"formula_reduced": "RbHSeO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.9016481952380957,
"spacegroup": 19
},
{
"id": "jvasp-52825",
"created_at": "2022-09-04T14:36:13.762685Z",
"updated_at": "2022-09-04T14:36:13.762716Z",
"structure_string": "Rb3 H3 Se3 O12\n1.0\n-4.631904 0.003311 0.003781\n-0.077088 -7.516054 -0.003675\n2.228007 3.732364 9.636576\nRb H Se O\n3 3 3 12\ndirect\n0.997883 0.492660 0.000268 Rb\n0.427913 0.919944 0.670295 Rb\n0.570698 0.251099 0.328702 Rb\n0.457083 0.873156 0.008111 H\n0.852890 0.554277 0.685036 H\n0.147236 0.870641 0.316379 H\n0.989522 0.001218 0.997150 Se\n0.295312 0.407016 0.665143 Se\n0.706943 0.742462 0.334527 Se\n0.929833 0.848872 0.260355 O\n0.070532 0.588447 0.740264 O\n0.918456 0.691763 0.461423 O\n0.085079 0.231694 0.537813 O\n0.475646 0.908672 0.393667 O\n0.290593 0.891350 0.064303 O\n0.945629 0.187608 0.131101 O\n0.065671 0.060863 0.871439 O\n0.468027 0.346506 0.795222 O\n0.706295 0.834714 0.935652 O\n0.524728 0.513551 0.606590 O\n0.536121 0.553897 0.203775 O\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Rb",
"H",
"Se",
"O"
],
"chemical_system": "H-O-Rb-Se",
"density": 3.4068516905959405,
"density_atomic": 0.06259586468737265,
"volume": 335.48542072039294,
"volume_molar": 9.620668697647748,
"formula_full": "Rb3 H3 Se3 O12",
"formula_reduced": "RbHSeO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.901786766666667,
"spacegroup": 1
},
{
"id": "jvasp-36735",
"created_at": "2022-09-04T14:38:00.297274Z",
"updated_at": "2022-09-04T14:38:00.297284Z",
"structure_string": "Rb2 Sr2 Si2 H2 O8\n1.0\n0.000000 5.813139 -0.039090\n7.840167 0.000000 0.000000\n0.000000 -2.868135 -5.106850\nRb Sr Si H O\n2 2 2 2 8\ndirect\n0.359128 0.231445 0.718891 Rb\n0.640871 0.731445 0.281109 Rb\n0.010241 0.486746 0.006376 Sr\n0.989759 0.986746 0.993624 Sr\n0.687779 0.245461 0.374870 Si\n0.312220 0.745461 0.625130 Si\n0.507023 0.004609 0.461548 H\n0.492977 0.504609 0.538452 H\n0.853380 0.237713 0.214855 O\n0.146619 0.737713 0.785145 O\n0.876210 0.240896 0.692914 O\n0.123790 0.740896 0.307087 O\n0.474601 0.403032 0.286840 O\n0.525399 0.903032 0.713160 O\n0.489675 0.067100 0.299940 O\n0.510324 0.567100 0.700060 O\n",
"nsites": 16,
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"elements": [
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"Sr",
"Si",
"H",
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],
"chemical_system": "H-O-Rb-Si-Sr",
"density": 3.7837848092523254,
"density_atomic": 0.06848473675741251,
"volume": 233.62869973020995,
"volume_molar": 8.793405720944364,
"formula_full": "Rb2 Sr2 Si2 H2 O8",
"formula_reduced": "RbSrSiHO4",
"formula_anonymous": "ABCDE4",
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"spacegroup": 4
},
{
"id": "jvasp-118472",
"created_at": "2022-09-04T14:38:51.588904Z",
"updated_at": "2022-09-04T14:38:51.588914Z",
"structure_string": "Re1 H1 O1\n1.0\n5.291772 0.000000 0.000000\n0.000000 5.291772 0.000000\n0.000000 0.000000 9.948532\nRe H O\n1 1 1\ndirect\n0.000000 0.000000 0.835447 Re\n0.000000 0.000000 0.220185 H\n0.000000 0.000000 0.010747 O\n",
"nsites": 3,
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"elements": [
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],
"chemical_system": "H-O-Re",
"density": 1.2112734536359546,
"density_atomic": 0.01076861884722485,
"volume": 278.58725826971965,
"volume_molar": 55.92305610809086,
"formula_full": "Re1 H1 O1",
"formula_reduced": "ReHO",
"formula_anonymous": "ABC",
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"spacegroup": 99
},
{
"id": "jvasp-76228",
"created_at": "2022-09-04T14:36:04.980402Z",
"updated_at": "2022-09-04T14:36:04.980437Z",
"structure_string": "Ho10 Rh6\n1.0\n8.167787 0.000000 -0.000000\n-4.083893 7.073511 -0.000000\n-0.000000 0.000000 6.236773\nHo Rh\n10 6\ndirect\n0.000000 0.751240 0.750000 Ho\n0.000000 0.248760 0.250000 Ho\n0.751241 0.751240 0.250000 Ho\n0.751240 0.000000 0.750000 Ho\n0.248760 0.248760 0.750000 Ho\n0.248760 0.000000 0.250000 Ho\n0.333333 0.666667 0.500000 Ho\n0.666667 0.333333 0.000000 Ho\n0.666667 0.333333 0.500000 Ho\n0.333333 0.666667 0.000000 Ho\n0.396582 0.000000 0.750000 Rh\n0.396582 0.396582 0.250000 Rh\n0.000000 0.603418 0.250000 Rh\n0.000000 0.396582 0.750000 Rh\n0.603418 0.603418 0.750000 Rh\n0.603418 0.000000 0.250000 Rh\n",
"nsites": 16,
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"elements": [
"Ho",
"Rh"
],
"chemical_system": "Ho-Rh",
"density": 10.44601640763317,
"density_atomic": 0.044403848112383563,
"volume": 360.3291309236291,
"volume_molar": 13.56220466469102,
"formula_full": "Ho10 Rh6",
"formula_reduced": "Ho5Rh3",
"formula_anonymous": "A3B5",
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"spacegroup": 193
},
{
"id": "jvasp-14773",
"created_at": "2022-09-04T14:38:08.101747Z",
"updated_at": "2022-09-04T14:38:08.101775Z",
"structure_string": "Ho2 Rh4\n1.0\n4.593841 0.000000 2.652256\n1.531280 4.331115 2.652256\n0.000000 0.000000 5.304511\nHo Rh\n2 4\ndirect\n0.125000 0.125000 0.125000 Ho\n0.874999 0.875001 0.875001 Ho\n0.500000 0.000000 0.500000 Rh\n-0.000000 0.500001 0.500000 Rh\n0.500000 0.500001 0.500001 Rh\n0.500000 0.500001 0.000001 Rh\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ho",
"Rh"
],
"chemical_system": "Ho-Rh",
"density": 11.666190285279141,
"density_atomic": 0.05684996756377816,
"volume": 105.540957314862,
"volume_molar": 10.593041681587511,
"formula_full": "Ho2 Rh4",
"formula_reduced": "HoRh2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.8622238555555557,
"spacegroup": 227
},
{
"id": "jvasp-20416",
"created_at": "2022-09-04T14:37:41.825685Z",
"updated_at": "2022-09-04T14:37:41.825717Z",
"structure_string": "Ho1 Rh1\n1.0\n3.396394 0.000000 0.000000\n0.000000 3.396394 0.000000\n0.000000 0.000000 3.396394\nHo Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 2,
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"elements": [
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],
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"volume": 39.17907650611753,
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"formula_full": "Ho1 Rh1",
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"spacegroup": 221
},
{
"id": "jvasp-20604",
"created_at": "2022-09-04T14:38:10.140924Z",
"updated_at": "2022-09-04T14:38:10.140951Z",
"structure_string": "Ho1 Rh1\n1.0\n3.396394 -0.000000 0.000000\n-0.000000 3.396394 -0.000000\n0.000000 0.000000 3.396394\nHo Rh\n1 1\ndirect\n0.000000 0.000000 0.000000 Ho\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 2,
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"elements": [
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"volume": 39.17907650611753,
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"formula_full": "Ho1 Rh1",
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"spacegroup": 221
},
{
"id": "jvasp-79836",
"created_at": "2022-09-04T14:36:44.518185Z",
"updated_at": "2022-09-04T14:36:44.518207Z",
"structure_string": "Ho2 Ru1 Rh1\n1.0\n0.000000 3.381484 3.381484\n3.381484 -0.000000 3.381484\n3.381484 3.381484 -0.000000\nHo Ru Rh\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Ho\n0.000000 0.000000 0.000000 Ho\n0.749998 0.749998 0.749998 Ru\n0.250000 0.250000 0.250000 Rh\n",
"nsites": 4,
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],
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"density": 11.463178705347726,
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"volume": 77.33071152588796,
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"formula_full": "Ho2 Ru1 Rh1",
"formula_reduced": "Ho2RuRh",
"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-41048",
"created_at": "2022-09-04T14:37:37.103952Z",
"updated_at": "2022-09-04T14:37:37.103964Z",
"structure_string": "Ho1 Sb1 Rh2\n1.0\n-0.000000 3.321110 3.321110\n3.321110 0.000000 3.321110\n3.321110 3.321110 -0.000000\nHo Sb Rh\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ho\n0.750000 0.750000 0.750000 Sb\n0.000000 0.000000 0.000000 Rh\n0.499999 0.499999 0.499999 Rh\n",
"nsites": 4,
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],
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"formula_full": "Ho1 Sb1 Rh2",
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"formula_anonymous": "ABC2",
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"spacegroup": 225
},
{
"id": "jvasp-22920",
"created_at": "2022-09-04T14:37:31.286783Z",
"updated_at": "2022-09-04T14:37:31.286793Z",
"structure_string": "Ho8 Si12 Rh4\n1.0\n4.088125 -7.080840 -0.000000\n4.088125 7.080840 -0.000000\n-0.000000 -0.000000 7.836644\nHo Si Rh\n8 12 4\ndirect\n0.491570 0.508429 0.750000 Ho\n0.016860 0.508429 0.750000 Ho\n0.508429 0.016860 0.250000 Ho\n0.508429 0.491570 0.250000 Ho\n0.983139 0.491569 0.250000 Ho\n0.491569 0.983139 0.750000 Ho\n0.000000 0.000000 0.250000 Ho\n0.000000 0.000000 0.750000 Ho\n0.333874 0.166937 0.999811 Si\n0.666125 0.833062 0.499811 Si\n0.166937 0.833062 0.499811 Si\n0.833062 0.166937 0.999811 Si\n0.833062 0.666125 0.999811 Si\n0.166937 0.333874 0.000189 Si\n0.166937 0.833062 0.000189 Si\n0.166937 0.333874 0.499811 Si\n0.833062 0.166937 0.500188 Si\n0.833062 0.666125 0.500188 Si\n0.333874 0.166937 0.500188 Si\n0.666125 0.833062 0.000189 Si\n0.333332 0.666666 0.467334 Rh\n0.666666 0.333332 0.967333 Rh\n0.333332 0.666666 0.032666 Rh\n0.666666 0.333332 0.532666 Rh\n",
"nsites": 24,
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"elements": [
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],
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"density": 7.569193159486888,
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"volume": 453.7002948382242,
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"formula_full": "Ho8 Si12 Rh4",
"formula_reduced": "Ho2Si3Rh",
"formula_anonymous": "AB2C3",
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"spacegroup": 194
}
]
}