HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=nelements&page=57",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=nelements&page=55",
"results": [
{
"id": "oqmd-1215599",
"created_at": "2022-09-04T15:39:04.995836Z",
"updated_at": "2022-09-04T15:39:04.995862Z",
"structure_string": "He2\n1.0\n0.000000 0.000000 -2.644166\n2.422710 2.422710 1.322083\n2.422710 -2.422710 -1.322083\nHe\n2\ndirect\n0.000000 0.000000 0.000000 He\n0.249999 0.500000 0.500000 He\n",
"nsites": 2,
"nelements": 1,
"elements": [
"He"
],
"chemical_system": "He",
"density": 0.4282525179624454,
"density_atomic": 0.06443300994916609,
"volume": 31.03999024068384,
"volume_molar": 9.346359520921219,
"formula_full": "He2",
"formula_reduced": "He",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 141
},
{
"id": "oqmd-1215392",
"created_at": "2022-09-04T15:39:04.999151Z",
"updated_at": "2022-09-04T15:39:04.999174Z",
"structure_string": "Ac4\n1.0\n4.007733 0.000000 0.000000\n-2.003867 3.470798 0.000000\n0.000000 0.000000 12.944740\nAc\n4\ndirect\n0.000000 0.000000 0.000000 Ac\n0.333334 0.666668 0.250000 Ac\n0.000000 0.000000 0.500000 Ac\n0.666667 0.333333 0.750000 Ac\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ac"
],
"chemical_system": "Ac",
"density": 8.373624753114912,
"density_atomic": 0.022214602181543964,
"volume": 180.06174350145358,
"volume_molar": 27.10892912141922,
"formula_full": "Ac4",
"formula_reduced": "Ac",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 194
},
{
"id": "oqmd-1215013",
"created_at": "2022-09-04T15:39:05.012622Z",
"updated_at": "2022-09-04T15:39:05.012644Z",
"structure_string": "Sc8\n1.0\n5.791455 0.000000 0.000000\n0.000000 5.791455 0.000000\n0.000000 0.000000 5.791455\nSc\n8\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.249999 0.000000 Sc\n0.500000 0.750000 0.000000 Sc\n0.000000 0.500000 0.249999 Sc\n0.249999 0.000000 0.500000 Sc\n0.750000 0.000000 0.500000 Sc\n0.500000 0.500000 0.500000 Sc\n0.000000 0.500000 0.750000 Sc\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Sc"
],
"chemical_system": "Sc",
"density": 3.0744174629700702,
"density_atomic": 0.04118384857459035,
"volume": 194.25090847230453,
"volume_molar": 14.62257891972618,
"formula_full": "Sc8",
"formula_reduced": "Sc",
"formula_anonymous": "A",
"formation_energy": 0.217610827500001,
"spacegroup": 223
},
{
"id": "oqmd-1215406",
"created_at": "2022-09-04T15:39:05.015948Z",
"updated_at": "2022-09-04T15:39:05.015973Z",
"structure_string": "Ce4\n1.0\n3.784082 0.000000 0.000000\n-1.892041 3.277112 0.000000\n0.000000 0.000000 12.115256\nCe\n4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333333 0.666666 0.250000 Ce\n0.000000 0.000000 0.500000 Ce\n0.666666 0.333333 0.750000 Ce\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ce"
],
"chemical_system": "Ce",
"density": 6.194587630012348,
"density_atomic": 0.02662413904977366,
"volume": 150.23959995559014,
"volume_molar": 22.61910046646634,
"formula_full": "Ce4",
"formula_reduced": "Ce",
"formula_anonymous": "A",
"formation_energy": 7.34649999998283e-05,
"spacegroup": 194
},
{
"id": "oqmd-1215429",
"created_at": "2022-09-04T15:39:05.024669Z",
"updated_at": "2022-09-04T15:39:05.024697Z",
"structure_string": "Kr4\n1.0\n3.910996 0.000000 0.000000\n-1.955499 3.387023 0.000000\n0.000000 0.000000 12.511121\nKr\n4\ndirect\n0.000000 0.000000 0.000000 Kr\n0.333334 0.666668 0.250000 Kr\n0.000000 0.000000 0.500000 Kr\n0.666668 0.333334 0.750000 Kr\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Kr"
],
"chemical_system": "Kr",
"density": 3.358466343098054,
"density_atomic": 0.024135608323406665,
"volume": 165.73023337144596,
"volume_molar": 24.951269838762425,
"formula_full": "Kr4",
"formula_reduced": "Kr",
"formula_anonymous": "A",
"formation_energy": 0.01513954,
"spacegroup": 194
},
{
"id": "oqmd-1215016",
"created_at": "2022-09-04T15:39:05.028276Z",
"updated_at": "2022-09-04T15:39:05.028303Z",
"structure_string": "Sm8\n1.0\n6.435422 0.000000 0.000000\n0.000000 6.435422 0.000000\n0.000000 0.000000 6.435422\nSm\n8\ndirect\n0.000000 0.000000 0.000000 Sm\n0.500000 0.250001 0.000000 Sm\n0.500000 0.750001 0.000000 Sm\n0.000000 0.500000 0.250001 Sm\n0.250001 0.000000 0.500000 Sm\n0.750001 0.000000 0.500000 Sm\n0.500000 0.500000 0.500000 Sm\n0.000000 0.500000 0.750001 Sm\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Sm"
],
"chemical_system": "Sm",
"density": 7.494459360919661,
"density_atomic": 0.030016420063284602,
"volume": 266.5207903918368,
"volume_molar": 20.06282144007621,
"formula_full": "Sm8",
"formula_reduced": "Sm",
"formula_anonymous": "A",
"formation_energy": 0.227852992500001,
"spacegroup": 223
},
{
"id": "oqmd-1214635",
"created_at": "2022-09-04T15:39:05.061200Z",
"updated_at": "2022-09-04T15:39:05.061226Z",
"structure_string": "Na1\n1.0\n-1.888790 1.090493 2.643729\n-1.888790 -1.090493 -2.643729\n0.000000 -2.180987 2.643729\nNa\n1\ndirect\n0.000000 0.000000 0.000000 Na\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Na"
],
"chemical_system": "Na",
"density": 1.1684465087386506,
"density_atomic": 0.03060730737610258,
"volume": 32.67193640106921,
"volume_molar": 19.67549999090066,
"formula_full": "Na1",
"formula_reduced": "Na",
"formula_anonymous": "A",
"formation_energy": 0.0265256200000001,
"spacegroup": 166
},
{
"id": "oqmd-1215413",
"created_at": "2022-09-04T15:39:05.068673Z",
"updated_at": "2022-09-04T15:39:05.068702Z",
"structure_string": "Er4\n1.0\n3.507483 0.000000 0.000000\n-1.753742 3.037570 0.000000\n0.000000 0.000000 11.283179\nEr\n4\ndirect\n0.000000 0.000000 0.000000 Er\n0.333334 0.666668 0.250000 Er\n0.000000 0.000000 0.500000 Er\n0.666666 0.333332 0.750000 Er\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Er"
],
"chemical_system": "Er",
"density": 9.241558926459142,
"density_atomic": 0.033274124989509844,
"volume": 120.21352931928513,
"volume_molar": 18.09856987042805,
"formula_full": "Er4",
"formula_reduced": "Er",
"formula_anonymous": "A",
"formation_energy": 0.0068965375000003,
"spacegroup": 194
},
{
"id": "oqmd-1215547",
"created_at": "2022-09-04T15:39:05.111242Z",
"updated_at": "2022-09-04T15:39:05.111273Z",
"structure_string": "Sb2\n1.0\n0.000000 3.494790 -3.494790\n3.494790 0.000000 3.494790\n0.000000 -3.494790 -3.494790\nSb\n2\ndirect\n0.000000 0.000000 0.000000 Sb\n0.249999 0.499999 0.749998 Sb\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Sb"
],
"chemical_system": "Sb",
"density": 4.736859287651349,
"density_atomic": 0.023428082621885463,
"volume": 85.36763474325849,
"volume_molar": 25.704795638608452,
"formula_full": "Sb2",
"formula_reduced": "Sb",
"formula_anonymous": "A",
"formation_energy": 0.30688994,
"spacegroup": 227
},
{
"id": "oqmd-1214829",
"created_at": "2022-09-04T15:39:05.127160Z",
"updated_at": "2022-09-04T15:39:05.127192Z",
"structure_string": "Rb29\n1.0\n8.719015 8.719015 -8.719015\n8.719015 -8.719015 8.719015\n-8.719015 -8.719015 -8.719015\nRb\n29\ndirect\n0.000000 0.000000 0.000000 Rb\n0.365525 0.000000 0.000000 Rb\n0.598253 0.318369 0.000000 Rb\n0.000000 0.365525 0.000000 Rb\n0.318369 0.598253 0.000000 Rb\n0.809925 0.627355 0.000000 Rb\n0.627355 0.809925 0.000000 Rb\n0.372645 0.372645 0.182570 Rb\n0.817431 0.190076 0.190076 Rb\n0.190076 0.817431 0.190076 Rb\n0.681631 0.681631 0.279885 Rb\n0.598253 0.000000 0.318369 Rb\n0.000000 0.598253 0.318369 Rb\n0.000000 0.000000 0.365525 Rb\n0.372645 0.182570 0.372645 Rb\n0.182570 0.372645 0.372645 Rb\n0.720115 0.401747 0.401747 Rb\n0.401747 0.720115 0.401747 Rb\n0.318369 0.000000 0.598253 Rb\n0.000000 0.318369 0.598253 Rb\n0.809925 0.000000 0.627355 Rb\n0.000000 0.809925 0.627355 Rb\n0.634475 0.634475 0.634475 Rb\n0.681631 0.279885 0.681631 Rb\n0.279885 0.681631 0.681631 Rb\n0.401747 0.401747 0.720115 Rb\n0.627355 0.000000 0.809925 Rb\n0.000000 0.627355 0.809925 Rb\n0.190076 0.190076 0.817431 Rb\n",
"nsites": 29,
"nelements": 1,
"elements": [
"Rb"
],
"chemical_system": "Rb",
"density": 1.5523418097923514,
"density_atomic": 0.010937944921284158,
"volume": 2651.3207196325216,
"volume_molar": 55.05733301217772,
"formula_full": "Rb29",
"formula_reduced": "Rb",
"formula_anonymous": "A",
"formation_energy": 0.010530418965517,
"spacegroup": 217
},
{
"id": "oqmd-1215734",
"created_at": "2022-09-04T15:39:05.378477Z",
"updated_at": "2022-09-04T15:39:05.378511Z",
"structure_string": "Tc1\n1.0\n0.000000 -2.729862 0.000000\n-2.729862 0.000000 0.000000\n1.364931 1.364931 -1.947288\nTc\n1\ndirect\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.21407869196321,
"density_atomic": 0.06891098000005817,
"volume": 14.51147552972191,
"volume_molar": 8.739014827528091,
"formula_full": "Tc1",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"formation_energy": 0.0698527050000006,
"spacegroup": 225
},
{
"id": "oqmd-1216089",
"created_at": "2022-09-04T15:39:08.913377Z",
"updated_at": "2022-09-04T15:39:08.913405Z",
"structure_string": "Sn3\n1.0\n-3.391672 -0.000000 0.000000\n1.695835 2.937274 0.000000\n-1.695835 -0.979091 -8.234895\nSn\n3\ndirect\n0.000000 0.000000 0.000000 Sn\n0.222487 0.777511 0.332537 Sn\n0.777512 0.222488 0.667463 Sn\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Sn"
],
"chemical_system": "Sn",
"density": 7.208439935117078,
"density_atomic": 0.03656830929515792,
"volume": 82.03824726447596,
"volume_molar": 16.46819575767864,
"formula_full": "Sn3",
"formula_reduced": "Sn",
"formula_anonymous": "A",
"formation_energy": 0.0697514233333298,
"spacegroup": 166
}
]
}