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{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=357",
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"results": [
{
"id": "jvasp-112860",
"created_at": "2022-09-04T14:38:44.967265Z",
"updated_at": "2022-09-04T14:38:44.967292Z",
"structure_string": "Zn2 Si4 Sn2 O12\n1.0\n6.627786 0.093817 1.602487\n0.173352 6.626183 1.602487\n-0.187077 -0.184846 5.381717\nZn Si Sn O\n2 4 2 12\ndirect\n0.602398 0.397602 0.250001 Zn\n0.397602 0.602397 0.750001 Zn\n0.871317 0.690901 0.776314 Si\n0.309099 0.128683 0.723689 Si\n0.690901 0.871317 0.276313 Si\n0.128683 0.309099 0.223688 Si\n0.786358 0.213641 0.750001 Sn\n0.213641 0.786358 0.250001 Sn\n0.898943 0.390137 0.307905 O\n0.609863 0.101057 0.192097 O\n0.522078 0.699240 0.358545 O\n0.300759 0.477922 0.141456 O\n0.477922 0.300759 0.641457 O\n0.149893 0.187374 0.981352 O\n0.850107 0.812626 0.018651 O\n0.187374 0.149893 0.481351 O\n0.101057 0.609862 0.692097 O\n0.812626 0.850106 0.518651 O\n0.699241 0.522077 0.858546 O\n0.390137 0.898942 0.807905 O\n",
"nsites": 20,
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"elements": [
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"density": 4.650931134056854,
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"volume": 240.13114306389897,
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"formula_full": "Zn2 Si4 Sn2 O12",
"formula_reduced": "ZnSi2SnO6",
"formula_anonymous": "ABC2D6",
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"spacegroup": 15
},
{
"id": "jvasp-21313",
"created_at": "2022-09-04T14:37:06.008445Z",
"updated_at": "2022-09-04T14:37:06.008471Z",
"structure_string": "Zn2 Si4 Sn2 O12\n1.0\n5.336013 0.162113 1.274346\n1.500823 7.085619 0.766569\n0.157827 0.080981 7.281115\nZn Si Sn O\n2 4 2 12\ndirect\n0.750000 0.299147 0.700854 Zn\n0.250001 0.700853 0.299149 Zn\n0.219849 0.171027 0.360228 Si\n0.280150 0.639772 0.828974 Si\n0.719848 0.360227 0.171028 Si\n0.780151 0.828973 0.639773 Si\n0.249999 0.154927 0.845075 Sn\n0.749998 0.845075 0.154927 Sn\n0.667791 0.056900 0.656961 O\n0.832209 0.343038 0.943101 O\n0.617840 0.580286 0.237391 O\n0.882158 0.762611 0.419715 O\n0.382158 0.419713 0.762611 O\n0.037318 0.751017 0.731125 O\n0.962680 0.248983 0.268877 O\n0.537319 0.731124 0.751019 O\n0.332207 0.943100 0.343040 O\n0.462682 0.268877 0.248983 O\n0.117842 0.237389 0.580286 O\n0.167792 0.656961 0.056901 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
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],
"chemical_system": "O-Si-Sn-Zn",
"density": 4.106941650047569,
"density_atomic": 0.07354618182073425,
"volume": 271.9379783541879,
"volume_molar": 8.188243918193765,
"formula_full": "Zn2 Si4 Sn2 O12",
"formula_reduced": "ZnSi2SnO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.1150660300000004,
"spacegroup": 15
},
{
"id": "jvasp-37209",
"created_at": "2022-09-04T14:38:07.458358Z",
"updated_at": "2022-09-04T14:38:07.458382Z",
"structure_string": "Si1 Sn1 O3\n1.0\n3.706498 0.000000 -0.000000\n0.000000 3.706498 0.000000\n-0.000000 0.000000 3.706498\nSi Sn O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Sn\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
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],
"chemical_system": "O-Si-Sn",
"density": 6.352324772598651,
"density_atomic": 0.09819258514788733,
"volume": 50.92034182081597,
"volume_molar": 6.13298931984537,
"formula_full": "Si1 Sn1 O3",
"formula_reduced": "SiSnO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 1.91511416,
"spacegroup": 221
},
{
"id": "jvasp-9832",
"created_at": "2022-09-04T14:38:35.544702Z",
"updated_at": "2022-09-04T14:38:35.544730Z",
"structure_string": "Si4 Sn2 O12\n1.0\n5.261751 0.110344 1.203372\n1.427039 6.464765 0.581359\n0.177350 -0.053209 6.643290\nSi Sn O\n4 2 12\ndirect\n0.235092 0.218431 0.386482 Si\n0.264911 0.613516 0.781568 Si\n0.735092 0.386481 0.218431 Si\n0.764912 0.781567 0.613516 Si\n0.250001 0.109049 0.890948 Sn\n0.750002 0.890948 0.109048 Sn\n0.648210 0.950019 0.810380 O\n0.851790 0.189619 0.049978 O\n0.692634 0.608154 0.096137 O\n0.807353 0.903869 0.391848 O\n0.307352 0.391846 0.903869 O\n0.540623 0.650018 0.634137 O\n0.959386 0.365870 0.349973 O\n0.351789 0.049978 0.189621 O\n0.040622 0.634135 0.650019 O\n0.459387 0.349974 0.365870 O\n0.192634 0.096135 0.608155 O\n0.148211 0.810380 0.950020 O\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Si",
"Sn",
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],
"chemical_system": "O-Si-Sn",
"density": 4.022648054607678,
"density_atomic": 0.0804882856194105,
"volume": 223.63502789850867,
"volume_molar": 7.4820089826185905,
"formula_full": "Si4 Sn2 O12",
"formula_reduced": "Si2SnO6",
"formula_anonymous": "AB2C6",
"energy_above_hull": 2.5041344333333333,
"spacegroup": 15
},
{
"id": "jvasp-21121",
"created_at": "2022-09-04T14:37:30.618911Z",
"updated_at": "2022-09-04T14:37:30.618931Z",
"structure_string": "Sm8 Si4 Te4 O16\n1.0\n6.273321 0.000000 0.000000\n0.000000 7.136894 0.000000\n0.000000 0.000000 11.174059\nSm Si Te O\n8 4 4 16\ndirect\n0.389131 0.750000 0.500000 Sm\n0.389131 0.750000 0.000000 Sm\n0.610868 0.250000 0.500000 Sm\n0.610868 0.250000 0.000000 Sm\n0.886786 0.964835 0.750000 Sm\n0.886786 0.535164 0.250000 Sm\n0.113214 0.464835 0.750000 Sm\n0.113214 0.035164 0.250000 Sm\n0.112544 0.250000 0.000000 Si\n0.887456 0.750000 0.000000 Si\n0.887456 0.750000 0.500000 Si\n0.112544 0.250000 0.500000 Si\n0.402612 0.082286 0.750000 Te\n0.402612 0.417713 0.250000 Te\n0.597388 0.582286 0.750000 Te\n0.597388 0.917713 0.250000 Te\n0.948353 0.266276 0.383402 O\n0.948353 0.233724 0.616598 O\n0.948353 0.233724 0.883402 O\n0.948353 0.266276 0.116598 O\n0.051647 0.766275 0.116598 O\n0.051647 0.766275 0.383402 O\n0.270339 0.074083 0.035422 O\n0.270339 0.425917 0.964578 O\n0.729660 0.925916 0.535422 O\n0.729660 0.925916 0.964578 O\n0.729660 0.574083 0.035422 O\n0.270339 0.425917 0.535422 O\n0.270339 0.074083 0.464578 O\n0.051647 0.733724 0.883402 O\n0.729660 0.574083 0.464578 O\n0.051647 0.733724 0.616598 O\n",
"nsites": 32,
"nelements": 4,
"elements": [
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"Si",
"Te",
"O"
],
"chemical_system": "O-Si-Sm-Te",
"density": 6.909255398854803,
"density_atomic": 0.06396350609452184,
"volume": 500.28527130317275,
"volume_molar": 9.414963512320297,
"formula_full": "Sm8 Si4 Te4 O16",
"formula_reduced": "Sm2SiTeO4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 2.0538735145833336,
"spacegroup": 57
},
{
"id": "jvasp-37221",
"created_at": "2022-09-04T14:37:54.008818Z",
"updated_at": "2022-09-04T14:37:54.008841Z",
"structure_string": "Sm1 Si1 O3\n1.0\n3.750719 0.000000 0.000000\n-0.000000 3.750719 0.000000\n0.000000 0.000000 3.750719\nSm Si O\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 0.500000 Si\n0.500000 0.500000 0.000000 O\n0.500000 0.000000 0.500000 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 5,
"nelements": 3,
"elements": [
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"O"
],
"chemical_system": "O-Si-Sm",
"density": 7.126327129937199,
"density_atomic": 0.0947602982399585,
"volume": 52.764713628682955,
"volume_molar": 6.355130652660382,
"formula_full": "Sm1 Si1 O3",
"formula_reduced": "SmSiO3",
"formula_anonymous": "ABC3",
"energy_above_hull": 2.004751595,
"spacegroup": 221
},
{
"id": "jvasp-58349",
"created_at": "2022-09-04T14:37:36.448886Z",
"updated_at": "2022-09-04T14:37:36.448910Z",
"structure_string": "Si3 O6\n1.0\n2.468845 -4.276166 0.000000\n2.468845 4.276166 -0.000000\n0.000000 -0.000000 5.449830\nSi O\n3 6\ndirect\n0.465589 0.465589 0.000000 Si\n0.534413 0.000000 0.333333 Si\n0.000000 0.534413 0.666667 Si\n0.588091 0.725622 0.219406 O\n0.137532 0.411911 0.886073 O\n0.274380 0.862470 0.552739 O\n0.725622 0.588091 0.780594 O\n0.862470 0.274380 0.447261 O\n0.411911 0.137532 0.113928 O\n",
"nsites": 9,
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"elements": [
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],
"chemical_system": "O-Si",
"density": 2.6011777249558463,
"density_atomic": 0.07821340220427321,
"volume": 115.06979298118658,
"volume_molar": 7.699627672852952,
"formula_full": "Si3 O6",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3850352000000004,
"spacegroup": 152
},
{
"id": "jvasp-51555",
"created_at": "2022-09-04T14:37:41.208876Z",
"updated_at": "2022-09-04T14:37:41.208896Z",
"structure_string": "Si6 O12\n1.0\n5.285219 0.000000 -0.000000\n0.000000 7.461275 0.000000\n0.000000 0.000000 8.223411\nSi O\n6 12\ndirect\n0.250000 0.213679 0.104086 Si\n0.750000 0.786321 0.895914 Si\n0.750000 0.213679 0.895914 Si\n0.250000 0.786321 0.104086 Si\n0.250000 0.500000 0.387231 Si\n0.750000 0.500000 0.612769 Si\n0.250000 0.679502 0.275192 O\n0.750000 0.320498 0.724808 O\n0.750000 0.679502 0.724808 O\n0.250000 0.320498 0.275192 O\n0.750000 0.000000 0.857465 O\n0.000000 0.731812 0.000000 O\n0.500000 0.268189 0.000000 O\n0.500000 0.500000 0.500000 O\n0.500000 0.731812 0.000000 O\n0.000000 0.268189 0.000000 O\n0.250000 0.000000 0.142535 O\n0.000000 0.500000 0.500000 O\n",
"nsites": 18,
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"elements": [
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],
"chemical_system": "O-Si",
"density": 1.8460069109094057,
"density_atomic": 0.05550658058063914,
"volume": 324.2858740658662,
"volume_molar": 10.849417667245998,
"formula_full": "Si6 O12",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.401301866666667,
"spacegroup": 51
},
{
"id": "jvasp-58348",
"created_at": "2022-09-04T14:37:41.134995Z",
"updated_at": "2022-09-04T14:37:41.135021Z",
"structure_string": "Si2 O4\n1.0\n4.218921 -0.000000 0.000000\n-0.000000 4.218921 0.000000\n0.000000 0.000000 2.702930\nSi O\n2 4\ndirect\n0.500000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n0.694033 0.694033 0.000000 O\n0.194034 0.805966 0.500000 O\n0.305966 0.305966 0.000000 O\n0.805966 0.194034 0.500000 O\n",
"nsites": 6,
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"elements": [
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"density": 4.147653941755634,
"density_atomic": 0.12471355680095991,
"volume": 48.110246824055125,
"volume_molar": 4.828777972880048,
"formula_full": "Si2 O4",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4218618666666671,
"spacegroup": 136
},
{
"id": "jvasp-58345",
"created_at": "2022-09-04T14:37:40.894074Z",
"updated_at": "2022-09-04T14:37:40.894094Z",
"structure_string": "Si3 O6\n1.0\n2.550835 -4.418176 -0.000000\n2.550835 4.418176 0.000000\n-0.000000 0.000000 5.595124\nSi O\n3 6\ndirect\n0.499999 0.499999 0.833332 Si\n0.500000 -0.000001 0.500000 Si\n-0.000001 0.500000 0.166667 Si\n0.415923 0.207962 0.666666 O\n0.207962 0.415923 0.000000 O\n0.207961 0.792037 0.333333 O\n0.584075 0.792037 0.666666 O\n0.792037 0.584075 0.000000 O\n0.792037 0.207961 0.333333 O\n",
"nsites": 9,
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],
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"density": 2.3733744732983975,
"density_atomic": 0.07136370978441837,
"volume": 126.11451993160071,
"volume_molar": 8.438659898976944,
"formula_full": "Si3 O6",
"formula_reduced": "SiO2",
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"energy_above_hull": 1.3907418666666669,
"spacegroup": 180
},
{
"id": "jvasp-58354",
"created_at": "2022-09-04T14:37:45.950484Z",
"updated_at": "2022-09-04T14:37:45.950501Z",
"structure_string": "Si4 O8\n1.0\n2.640730 -4.573880 0.000000\n2.640730 4.573880 0.000000\n0.000000 0.000000 8.618096\nSi O\n4 8\ndirect\n0.333333 0.666667 0.562416 Si\n0.666667 0.333333 0.062415 Si\n0.666667 0.333333 0.437585 Si\n0.333333 0.666667 0.937585 Si\n0.500000 0.500000 0.500000 O\n0.500000 -0.000000 0.000000 O\n-0.000000 0.500000 0.000000 O\n-0.000000 0.500000 0.500000 O\n0.333333 0.666667 0.750000 O\n0.666667 0.333333 0.250000 O\n0.500000 0.500000 0.000000 O\n0.500000 -0.000000 0.500000 O\n",
"nsites": 12,
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"elements": [
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],
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"density_atomic": 0.057640953625462774,
"volume": 208.1853134834158,
"volume_molar": 10.447677183015466,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4022085333333338,
"spacegroup": 194
},
{
"id": "jvasp-34674",
"created_at": "2022-09-04T14:38:08.322090Z",
"updated_at": "2022-09-04T14:38:08.322116Z",
"structure_string": "Si4 O8\n1.0\n4.776527 0.000000 0.000000\n0.000000 5.838264 -0.709773\n0.000000 0.108275 5.880253\nSi O\n4 8\ndirect\n0.362714 0.034367 0.348877 Si\n0.862714 0.965632 0.651123 Si\n0.137287 0.651122 0.965632 Si\n0.637287 0.348877 0.034367 Si\n0.398575 0.479442 0.896724 O\n0.601425 0.896723 0.479443 O\n0.000000 0.733866 0.733867 O\n0.898576 0.520557 0.103276 O\n0.101425 0.103275 0.520557 O\n0.250000 0.872745 0.127255 O\n0.500000 0.266132 0.266132 O\n0.750001 0.127254 0.872745 O\n",
"nsites": 12,
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"elements": [
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],
"chemical_system": "O-Si",
"density": 2.4283261136947956,
"density_atomic": 0.07301602085523573,
"volume": 164.3474933233029,
"volume_molar": 8.247697819550751,
"formula_full": "Si4 O8",
"formula_reduced": "SiO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3932185333333336,
"spacegroup": 20
}
]
}