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=elements&page=94",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=elements&page=92",
"results": [
{
"id": "oqmd-1215159",
"created_at": "2022-09-04T15:39:04.644222Z",
"updated_at": "2022-09-04T15:39:04.644258Z",
"structure_string": "Ir1\n1.0\n1.552200 1.552200 1.552200\n1.552200 -1.552200 -1.552200\n-1.552200 1.552200 -1.552200\nIr\n1\ndirect\n0.000000 0.000000 0.000000 Ir\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 21.337221401712785,
"density_atomic": 0.06684931652913335,
"volume": 14.959016066592,
"volume_molar": 9.008530038411855,
"formula_full": "Ir1",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"formation_energy": 0.61196501,
"spacegroup": 229
},
{
"id": "oqmd-1214714",
"created_at": "2022-09-04T15:39:03.598843Z",
"updated_at": "2022-09-04T15:39:03.598867Z",
"structure_string": "Ir4\n1.0\n-1.932998 -4.253140 0.000000\n-1.932998 4.253140 0.000000\n0.000000 0.000000 -3.865702\nIr\n4\ndirect\n0.856341 0.143660 0.000000 Ir\n0.143660 0.856341 0.000000 Ir\n0.643660 0.356341 0.499904 Ir\n0.356341 0.643660 0.500096 Ir\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 20.086368812857717,
"density_atomic": 0.06293040698278791,
"volume": 63.56227762985927,
"volume_molar": 9.569524572830293,
"formula_full": "Ir4",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"formation_energy": 0.382014782500001,
"spacegroup": 139
},
{
"id": "oqmd-1215516",
"created_at": "2022-09-04T15:39:04.760000Z",
"updated_at": "2022-09-04T15:39:04.760027Z",
"structure_string": "Ir2\n1.0\n0.000000 2.773926 -2.773926\n2.773926 0.000000 2.773926\n0.000000 -2.773926 -2.773926\nIr\n2\ndirect\n0.000000 0.000000 0.000000 Ir\n0.250000 0.499999 0.749999 Ir\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 14.953962201949187,
"density_atomic": 0.04685062472672998,
"volume": 42.688865125397726,
"volume_molar": 12.853917733490007,
"formula_full": "Ir2",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"formation_energy": 1.005227255,
"spacegroup": 227
},
{
"id": "oqmd-1214981",
"created_at": "2022-09-04T15:39:03.792184Z",
"updated_at": "2022-09-04T15:39:03.792202Z",
"structure_string": "Ir8\n1.0\n4.924723 0.000000 0.000000\n0.000000 4.924723 0.000000\n0.000000 0.000000 4.924723\nIr\n8\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.250000 0.000000 Ir\n0.500000 0.750000 0.000000 Ir\n0.000000 0.500000 0.250000 Ir\n0.250000 0.000000 0.500000 Ir\n0.750000 0.000000 0.500000 Ir\n0.500000 0.500000 0.500000 Ir\n0.000000 0.500000 0.750000 Ir\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Ir"
],
"chemical_system": "Ir",
"density": 21.378904915471793,
"density_atomic": 0.06697991059069654,
"volume": 119.43879783427472,
"volume_molar": 8.99096565953982,
"formula_full": "Ir8",
"formula_reduced": "Ir",
"formula_anonymous": "A",
"formation_energy": 0.509498125,
"spacegroup": 223
},
{
"id": "oqmd-1215962",
"created_at": "2022-09-04T15:39:05.720552Z",
"updated_at": "2022-09-04T15:39:05.720592Z",
"structure_string": "K4\n1.0\n6.072036 -0.000000 0.000000\n-3.036019 5.258538 0.000000\n0.000000 0.000000 8.666852\nK\n4\ndirect\n0.000000 0.000000 0.250000 K\n0.333333 0.666666 0.250000 K\n0.000000 0.000000 0.750000 K\n0.666667 0.333334 0.750000 K\n",
"nsites": 4,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.9384393902596361,
"density_atomic": 0.014454372964617667,
"volume": 276.732862075128,
"volume_molar": 41.66310620835217,
"formula_full": "K4",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.326132825,
"spacegroup": 194
},
{
"id": "oqmd-1214715",
"created_at": "2022-09-04T15:39:03.617202Z",
"updated_at": "2022-09-04T15:39:03.617239Z",
"structure_string": "K4\n1.0\n-3.617377 -7.140142 0.000000\n-3.617377 7.140142 0.000000\n0.000000 0.000000 -5.299975\nK\n4\ndirect\n0.136232 0.863769 0.025679 K\n0.636232 0.363769 0.474321 K\n0.363769 0.636232 0.525678 K\n0.863769 0.136232 0.974322 K\n",
"nsites": 4,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.9485550158115493,
"density_atomic": 0.014610179536694015,
"volume": 273.781714314588,
"volume_molar": 41.2188005279139,
"formula_full": "K4",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.0723156025,
"spacegroup": 64
},
{
"id": "oqmd-1215606",
"created_at": "2022-09-04T15:39:05.648361Z",
"updated_at": "2022-09-04T15:39:05.648390Z",
"structure_string": "K2\n1.0\n0.000000 0.000000 -4.424869\n4.073790 4.073790 2.212434\n4.073790 -4.073790 -2.212434\nK\n2\ndirect\n0.000000 0.000000 0.000000 K\n0.250001 0.500000 0.500000 K\n",
"nsites": 2,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8841160582777853,
"density_atomic": 0.013617654355726823,
"volume": 146.86817184186438,
"volume_molar": 44.22304019977879,
"formula_full": "K2",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.065058745,
"spacegroup": 141
},
{
"id": "oqmd-20089",
"created_at": "2022-09-04T14:49:06.500743Z",
"updated_at": "2022-09-04T14:49:06.500780Z",
"structure_string": "K1\n1.0\n4.215880 0.000000 0.000000\n0.000000 4.215880 0.000000\n0.000000 0.000000 4.215422\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8665416323752259,
"density_atomic": 0.01334696313232842,
"volume": 74.9234106729376,
"volume_molar": 45.11993252917165,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.106326935,
"spacegroup": 221
},
{
"id": "oqmd-8500",
"created_at": "2022-09-04T14:48:47.586104Z",
"updated_at": "2022-09-04T14:48:47.586118Z",
"structure_string": "K1\n1.0\n2.619236 2.619236 2.619236\n2.619236 -2.619236 -2.619236\n-2.619236 2.619236 -2.619236\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.9032814405138564,
"density_atomic": 0.013912850386205667,
"volume": 71.87599753041846,
"volume_molar": 43.28473743935924,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.0003093650000001,
"spacegroup": 229
},
{
"id": "oqmd-1215160",
"created_at": "2022-09-04T15:39:05.934739Z",
"updated_at": "2022-09-04T15:39:05.934767Z",
"structure_string": "K1\n1.0\n2.612465 2.612465 -2.612465\n2.612465 -2.612465 2.612465\n-2.612465 -2.612465 -2.612465\nK\n1\ndirect\n0.000000 0.000000 0.000000 K\n",
"nsites": 1,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.9103230477114745,
"density_atomic": 0.014021309193200703,
"volume": 71.32001628527856,
"volume_molar": 42.949917707543975,
"formula_full": "K1",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.0006914049999999,
"spacegroup": 229
},
{
"id": "oqmd-21103",
"created_at": "2022-09-04T14:48:58.476844Z",
"updated_at": "2022-09-04T14:48:58.476870Z",
"structure_string": "K8\n1.0\n11.437858 0.000000 0.000000\n0.000000 4.559638 0.000000\n0.000000 0.000000 11.505868\nK\n8\ndirect\n0.323313 0.750000 0.026231 K\n0.011166 0.249998 0.178005 K\n0.511166 0.249998 0.321996 K\n0.823312 0.750000 0.473770 K\n0.176687 0.249998 0.526230 K\n0.488834 0.750000 0.678004 K\n0.988834 0.750000 0.821995 K\n0.676688 0.249998 0.973769 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8655706200909069,
"density_atomic": 0.013332007053271587,
"volume": 600.0596885400577,
"volume_molar": 45.17054885987482,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.0350685312500001,
"spacegroup": 62
},
{
"id": "oqmd-20428",
"created_at": "2022-09-04T14:49:15.788586Z",
"updated_at": "2022-09-04T14:49:15.788618Z",
"structure_string": "K8\n1.0\n-6.669710 -4.634587 0.000000\n-6.669710 4.634587 0.000000\n0.000000 0.000000 -9.253931\nK\n8\ndirect\n0.244026 0.244026 0.000000 K\n0.755974 0.755974 0.000000 K\n0.734412 0.265587 0.234199 K\n0.234412 0.765586 0.265801 K\n0.255974 0.255974 0.500000 K\n0.744026 0.744026 0.500000 K\n0.765586 0.234412 0.734200 K\n0.265587 0.734412 0.765801 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.9078680159045605,
"density_atomic": 0.01398349540815986,
"volume": 572.1030233493493,
"volume_molar": 43.06606169789186,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.0020219375000001,
"spacegroup": 64
}
]
}