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=density_atomic&page=43",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=density_atomic&page=41",
"results": [
{
"id": "oqmd-1237224",
"created_at": "2022-09-04T15:40:41.673703Z",
"updated_at": "2022-09-04T15:40:41.673720Z",
"structure_string": "Yb4 Pb2\n1.0\n4.924924 2.843406 8.042368\n-4.924924 2.843406 8.042368\n0.000000 -5.686813 8.042368\nPb Yb\n2 4\ndirect\n0.125000 0.125000 0.125000 Pb\n0.875000 0.875000 0.875000 Pb\n0.000000 0.000000 0.000000 Yb\n0.500000 0.000000 0.000000 Yb\n0.000000 0.500000 0.000000 Yb\n0.000000 0.000000 0.500000 Yb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pb",
"Yb"
],
"chemical_system": "Pb-Yb",
"density": 2.7192579907541017,
"density_atomic": 0.008879276888050404,
"volume": 675.7307014577627,
"volume_molar": 67.82242333386975,
"formula_full": "Yb4 Pb2",
"formula_reduced": "Yb2Pb",
"formula_anonymous": "AB2",
"formation_energy": 0.403886575,
"spacegroup": 227
},
{
"id": "oqmd-1240376",
"created_at": "2022-09-04T15:40:52.167420Z",
"updated_at": "2022-09-04T15:40:52.167447Z",
"structure_string": "Ca4 Ta2\n1.0\n4.924114 2.842938 8.041044\n-4.924114 2.842938 8.041044\n0.000000 -5.685877 8.041044\nCa Ta\n4 2\ndirect\n0.625000 0.625000 0.125001 Ca\n0.625000 0.125001 0.625000 Ca\n0.125001 0.625000 0.625000 Ca\n0.625000 0.625000 0.625000 Ca\n0.499999 0.499999 0.499999 Ta\n0.750000 0.750000 0.750000 Ta\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Ta"
],
"chemical_system": "Ca-Ta",
"density": 1.2839058903984588,
"density_atomic": 0.008883661932459161,
"volume": 675.397155544289,
"volume_molar": 67.78894565985539,
"formula_full": "Ca4 Ta2",
"formula_reduced": "Ca2Ta",
"formula_anonymous": "AB2",
"formation_energy": 2.39016165,
"spacegroup": 227
},
{
"id": "oqmd-1240406",
"created_at": "2022-09-04T15:40:54.009068Z",
"updated_at": "2022-09-04T15:40:54.009087Z",
"structure_string": "Rb2 Pr4\n1.0\n4.923836 2.842778 8.040590\n-4.923836 2.842778 8.040590\n0.000000 -5.685556 8.040590\nPr Rb\n4 2\ndirect\n0.375000 0.375000 0.375000 Pr\n0.875000 0.375000 0.375000 Pr\n0.375000 0.875000 0.375000 Pr\n0.375000 0.375000 0.875000 Pr\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Rb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Rb"
],
"chemical_system": "Pr-Rb",
"density": 1.8063185650453726,
"density_atomic": 0.008885166232693763,
"volume": 675.2828076443257,
"volume_molar": 67.77746867403555,
"formula_full": "Rb2 Pr4",
"formula_reduced": "RbPr2",
"formula_anonymous": "AB2",
"formation_energy": 2.99773872,
"spacegroup": 227
},
{
"id": "oqmd-1240290",
"created_at": "2022-09-04T15:40:52.586518Z",
"updated_at": "2022-09-04T15:40:52.586547Z",
"structure_string": "Pr2 Te4\n1.0\n4.922943 2.842263 8.039133\n-4.922943 2.842263 8.039133\n0.000000 -5.684525 8.039133\nPr Te\n2 4\ndirect\n0.500000 0.500000 0.500000 Pr\n0.750000 0.750000 0.750000 Pr\n0.625000 0.625000 0.125000 Te\n0.625000 0.125000 0.625000 Te\n0.125000 0.625000 0.625000 Te\n0.625000 0.625000 0.625000 Te\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Pr",
"Te"
],
"chemical_system": "Pr-Te",
"density": 1.9491391335156372,
"density_atomic": 0.0088900001503975,
"volume": 674.9156241276015,
"volume_molar": 67.74061482699447,
"formula_full": "Pr2 Te4",
"formula_reduced": "PrTe2",
"formula_anonymous": "AB2",
"formation_energy": -0.492143808055553,
"spacegroup": 227
},
{
"id": "oqmd-1454311",
"created_at": "2022-09-04T15:51:31.315582Z",
"updated_at": "2022-09-04T15:51:31.315606Z",
"structure_string": "Cs14 C1\n1.0\n7.113622 4.107051 9.622065\n-7.113622 4.107051 9.622065\n0.000000 -8.214103 9.622065\nC Cs\n1 14\ndirect\n0.500000 0.500000 0.500000 C\n0.674069 0.325931 0.000000 Cs\n0.325931 0.674069 0.000000 Cs\n0.686671 0.686671 0.115750 Cs\n0.884250 0.313329 0.313329 Cs\n0.313329 0.884250 0.313329 Cs\n0.674069 0.000000 0.325931 Cs\n0.000000 0.674069 0.325931 Cs\n0.403580 0.403580 0.403580 Cs\n0.596420 0.596420 0.596420 Cs\n0.325931 0.000000 0.674069 Cs\n0.000000 0.325931 0.674069 Cs\n0.686671 0.115750 0.686671 Cs\n0.115750 0.686671 0.686671 Cs\n0.313329 0.313329 0.884250 Cs\n",
"nsites": 15,
"nelements": 2,
"elements": [
"C",
"Cs"
],
"chemical_system": "C-Cs",
"density": 1.8436303433880745,
"density_atomic": 0.008893051495063106,
"volume": 1686.710125127141,
"volume_molar": 67.71737196555237,
"formula_full": "Cs14 C1",
"formula_reduced": "Cs14C",
"formula_anonymous": "AB14",
"formation_energy": 0.4476029135000001,
"spacegroup": 166
},
{
"id": "oqmd-1237279",
"created_at": "2022-09-04T15:40:42.421405Z",
"updated_at": "2022-09-04T15:40:42.421437Z",
"structure_string": "Tb2 Ho4\n1.0\n4.922012 2.841725 8.037611\n-4.922012 2.841725 8.037611\n0.000000 -5.683450 8.037611\nHo Tb\n4 2\ndirect\n0.000000 0.000000 0.000000 Ho\n0.500000 0.000000 0.000000 Ho\n0.000000 0.500000 0.000000 Ho\n0.000000 0.000000 0.500000 Ho\n0.125000 0.125000 0.125000 Tb\n0.875000 0.875000 0.875000 Tb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ho",
"Tb"
],
"chemical_system": "Ho-Tb",
"density": 2.4065500164309555,
"density_atomic": 0.008895048086342975,
"volume": 674.5326098025382,
"volume_molar": 67.70217205735068,
"formula_full": "Tb2 Ho4",
"formula_reduced": "TbHo2",
"formula_anonymous": "AB2",
"formation_energy": 2.75546669288889,
"spacegroup": 227
},
{
"id": "oqmd-1238839",
"created_at": "2022-09-04T15:40:47.693752Z",
"updated_at": "2022-09-04T15:40:47.693782Z",
"structure_string": "Ba2 S4\n1.0\n0.000000 6.959953 6.959953\n6.959953 0.000000 6.959953\n6.959953 6.959953 0.000000\nBa S\n2 4\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.250000 0.250000 Ba\n0.125000 0.125000 0.125000 S\n0.625000 0.125000 0.125000 S\n0.125000 0.625000 0.125000 S\n0.125000 0.125000 0.625000 S\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"S"
],
"chemical_system": "Ba-S",
"density": 0.9922304237426157,
"density_atomic": 0.008898203507742246,
"volume": 674.2934115610476,
"volume_molar": 67.67816396602066,
"formula_full": "Ba2 S4",
"formula_reduced": "BaS2",
"formula_anonymous": "AB2",
"formation_energy": -0.247138161008905,
"spacegroup": 227
},
{
"id": "oqmd-1239735",
"created_at": "2022-09-04T15:40:51.455213Z",
"updated_at": "2022-09-04T15:40:51.455237Z",
"structure_string": "Th2 Sb4\n1.0\n4.921189 2.841250 8.036268\n-4.921189 2.841250 8.036268\n0.000000 -5.682499 8.036268\nSb Th\n4 2\ndirect\n0.375000 0.375000 0.375000 Sb\n0.874999 0.375000 0.375000 Sb\n0.375000 0.874999 0.375000 Sb\n0.375000 0.375000 0.874999 Sb\n0.250000 0.250000 0.250000 Th\n0.500000 0.500000 0.500000 Th\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Sb",
"Th"
],
"chemical_system": "Sb-Th",
"density": 2.342596745347295,
"density_atomic": 0.00889951103926691,
"volume": 674.1943432090226,
"volume_molar": 67.6682205733414,
"formula_full": "Th2 Sb4",
"formula_reduced": "ThSb2",
"formula_anonymous": "AB2",
"formation_energy": 0.67646884,
"spacegroup": 227
},
{
"id": "oqmd-1239995",
"created_at": "2022-09-04T15:40:53.580974Z",
"updated_at": "2022-09-04T15:40:53.580993Z",
"structure_string": "Na4 Hf2\n1.0\n0.000000 6.959166 6.959166\n6.959166 0.000000 6.959166\n6.959166 6.959166 0.000000\nHf Na\n2 4\ndirect\n0.500000 0.500000 0.500000 Hf\n0.750000 0.750000 0.750000 Hf\n0.625000 0.625000 0.125000 Na\n0.625000 0.125000 0.625000 Na\n0.125000 0.625000 0.625000 Na\n0.625000 0.625000 0.625000 Na\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Hf",
"Na"
],
"chemical_system": "Hf-Na",
"density": 1.1059485489726073,
"density_atomic": 0.008901222696306516,
"volume": 674.0646992788583,
"volume_molar": 67.65520834007258,
"formula_full": "Na4 Hf2",
"formula_reduced": "Na2Hf",
"formula_anonymous": "AB2",
"formation_energy": 2.2115493510989,
"spacegroup": 227
},
{
"id": "oqmd-1238708",
"created_at": "2022-09-04T15:40:46.347228Z",
"updated_at": "2022-09-04T15:40:46.347252Z",
"structure_string": "Yb4 Cr2\n1.0\n4.920231 2.840697 8.034704\n-4.920231 2.840697 8.034704\n0.000000 -5.681394 8.034704\nCr Yb\n2 4\ndirect\n0.250000 0.250000 0.250000 Cr\n0.500000 0.500000 0.500000 Cr\n0.374999 0.374999 0.374999 Yb\n0.874998 0.374999 0.374999 Yb\n0.374999 0.874998 0.374999 Yb\n0.374999 0.374999 0.874998 Yb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cr",
"Yb"
],
"chemical_system": "Cr-Yb",
"density": 1.962066212523493,
"density_atomic": 0.00890470860948938,
"volume": 673.8008241624042,
"volume_molar": 67.62872345516678,
"formula_full": "Yb4 Cr2",
"formula_reduced": "Yb2Cr",
"formula_anonymous": "AB2",
"formation_energy": 1.44459707333333,
"spacegroup": 227
},
{
"id": "oqmd-1241635",
"created_at": "2022-09-04T15:41:37.358489Z",
"updated_at": "2022-09-04T15:41:37.358518Z",
"structure_string": "K4 Pd2\n1.0\n4.919173 2.840086 8.032976\n-4.919173 2.840086 8.032976\n0.000000 -5.680172 8.032976\nK Pd\n4 2\ndirect\n0.625000 0.625000 0.125001 K\n0.625000 0.125001 0.625000 K\n0.125001 0.625000 0.625000 K\n0.625000 0.625000 0.625000 K\n0.500000 0.500000 0.500000 Pd\n0.750000 0.750000 0.750000 Pd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"K",
"Pd"
],
"chemical_system": "K-Pd",
"density": 0.9105389629856235,
"density_atomic": 0.008910456271741758,
"volume": 673.3661910252727,
"volume_molar": 67.58509975632069,
"formula_full": "K4 Pd2",
"formula_reduced": "K2Pd",
"formula_anonymous": "AB2",
"formation_energy": 0.28975598,
"spacegroup": 227
},
{
"id": "oqmd-1236637",
"created_at": "2022-09-04T15:40:28.205860Z",
"updated_at": "2022-09-04T15:40:28.205883Z",
"structure_string": "Er2 Sn4\n1.0\n4.918948 2.839956 8.032609\n-4.918948 2.839956 8.032609\n0.000000 -5.679912 8.032609\nEr Sn\n2 4\ndirect\n0.500000 0.500000 0.500000 Er\n0.750000 0.750000 0.750000 Er\n0.625000 0.625000 0.125000 Sn\n0.625000 0.125000 0.625000 Sn\n0.125000 0.625000 0.625000 Sn\n0.625000 0.625000 0.625000 Sn\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Er",
"Sn"
],
"chemical_system": "Er-Sn",
"density": 1.9961723717635316,
"density_atomic": 0.008911678892260768,
"volume": 673.2738098553598,
"volume_molar": 67.57582754950752,
"formula_full": "Er2 Sn4",
"formula_reduced": "ErSn2",
"formula_anonymous": "AB2",
"formation_energy": 1.16644896876587,
"spacegroup": 227
}
]
}