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=57",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=elements&page=55",
"results": [
{
"id": "oqmd-1522153",
"created_at": "2022-09-04T15:54:10.037027Z",
"updated_at": "2022-09-04T15:54:10.037055Z",
"structure_string": "Cu1\n1.0\n-1.433540 1.433540 1.433540\n1.433540 -1.433540 1.433540\n1.433540 1.433540 -1.433540\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 8.954634786481561,
"density_atomic": 0.08486147225194379,
"volume": 11.783910571703457,
"volume_molar": 7.09643681660503,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0354578,
"spacegroup": 229
},
{
"id": "oqmd-1214876",
"created_at": "2022-09-04T15:39:03.630952Z",
"updated_at": "2022-09-04T15:39:03.630984Z",
"structure_string": "Cu20\n1.0\n6.197377 0.000000 0.000000\n0.000000 6.197377 0.000000\n0.000000 0.000000 6.197377\nCu\n20\ndirect\n0.874999 0.700480 0.049521 Cu\n0.058685 0.058685 0.058685 Cu\n0.200480 0.450479 0.125000 Cu\n0.808684 0.308685 0.191315 Cu\n0.450479 0.125000 0.200480 Cu\n0.549520 0.625000 0.299520 Cu\n0.191315 0.808684 0.308685 Cu\n0.799521 0.950480 0.375001 Cu\n0.941316 0.558685 0.441316 Cu\n0.125000 0.200480 0.450479 Cu\n0.625000 0.299520 0.549520 Cu\n0.441316 0.941316 0.558685 Cu\n0.299520 0.549520 0.625000 Cu\n0.691315 0.691315 0.691315 Cu\n0.049521 0.874999 0.700480 Cu\n0.950480 0.375001 0.799521 Cu\n0.308685 0.191315 0.808684 Cu\n0.700480 0.049521 0.874999 Cu\n0.558685 0.441316 0.941316 Cu\n0.375001 0.799521 0.950480 Cu\n",
"nsites": 20,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 8.866323303121083,
"density_atomic": 0.08402456011946499,
"volume": 238.02564359235285,
"volume_molar": 7.167119651013705,
"formula_full": "Cu20",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0603619750000002,
"spacegroup": 213
},
{
"id": "oqmd-1215143",
"created_at": "2022-09-04T15:39:05.842180Z",
"updated_at": "2022-09-04T15:39:05.842212Z",
"structure_string": "Cu1\n1.0\n1.430943 1.430943 1.430943\n1.430943 -1.430943 -1.430943\n-1.430943 1.430943 -1.430943\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 9.003478278384705,
"density_atomic": 0.08532435328859803,
"volume": 11.719983351267087,
"volume_molar": 7.057938944618693,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0370161700000002,
"spacegroup": 229
},
{
"id": "oqmd-1215054",
"created_at": "2022-09-04T15:39:03.806034Z",
"updated_at": "2022-09-04T15:39:03.806067Z",
"structure_string": "Cu4\n1.0\n0.000000 0.000000 2.710522\n3.985843 0.000000 0.000000\n1.992921 4.461929 0.000000\nCu\n4\ndirect\n0.998738 0.366550 0.266900 Cu\n0.501265 0.866549 0.266900 Cu\n0.498738 0.133450 0.733100 Cu\n0.001265 0.633449 0.733100 Cu\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 8.755914804128484,
"density_atomic": 0.08297823852209689,
"volume": 48.20540989111031,
"volume_molar": 7.257494093944064,
"formula_full": "Cu4",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.1970606775,
"spacegroup": 69
},
{
"id": "oqmd-594519",
"created_at": "2022-09-04T15:15:51.057894Z",
"updated_at": "2022-09-04T15:15:51.057930Z",
"structure_string": "Cu1\n1.0\n1.802339 -1.802339 0.000000\n-1.802339 0.000000 -1.802339\n1.802339 1.802339 0.000000\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 9.011516439233253,
"density_atomic": 0.08540052950126004,
"volume": 11.709529271539768,
"volume_molar": 7.051643350655275,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0008575699999999,
"spacegroup": 225
},
{
"id": "oqmd-1522150",
"created_at": "2022-09-04T15:54:09.997289Z",
"updated_at": "2022-09-04T15:54:09.997316Z",
"structure_string": "Cu1\n1.0\n-1.433540 1.433540 1.433540\n1.433540 -1.433540 1.433540\n1.433540 1.433540 -1.433540\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 8.954634786481561,
"density_atomic": 0.08486147225194379,
"volume": 11.783910571703457,
"volume_molar": 7.09643681660503,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0354578,
"spacegroup": 229
},
{
"id": "oqmd-1215678",
"created_at": "2022-09-04T15:39:06.356882Z",
"updated_at": "2022-09-04T15:39:06.356921Z",
"structure_string": "Cu1\n1.0\n-2.520726 0.000000 0.000000\n0.000000 -2.520726 0.000000\n1.260363 1.260363 1.838648\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 9.03207302711319,
"density_atomic": 0.08559534060786168,
"volume": 11.682878914885151,
"volume_molar": 7.0355941307474446,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0028896999999998,
"spacegroup": 225
},
{
"id": "oqmd-598513",
"created_at": "2022-09-04T15:15:51.023752Z",
"updated_at": "2022-09-04T15:15:51.023780Z",
"structure_string": "Cu1\n1.0\n1.803428 -1.803428 0.000000\n-1.803428 0.000000 -1.803428\n1.803428 1.803428 0.000000\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 8.995201482348714,
"density_atomic": 0.08524591557294674,
"volume": 11.730767313353317,
"volume_molar": 7.06443319838207,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0003484500000001,
"spacegroup": 225
},
{
"id": "oqmd-592441",
"created_at": "2022-09-04T15:15:49.730122Z",
"updated_at": "2022-09-04T15:15:49.730148Z",
"structure_string": "Cu1\n1.0\n1.803214 -1.803214 0.000000\n-1.803214 0.000000 -1.803214\n1.803214 1.803214 0.000000\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 8.998404432596876,
"density_atomic": 0.0852762693595712,
"volume": 11.72659178819673,
"volume_molar": 7.061918638358082,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.00034255,
"spacegroup": 225
},
{
"id": "oqmd-1214520",
"created_at": "2022-09-04T15:39:02.876228Z",
"updated_at": "2022-09-04T15:39:02.876256Z",
"structure_string": "Cu1\n1.0\n0.000000 1.802876 -1.802876\n1.802876 0.000000 1.802876\n0.000000 -1.802876 -1.802876\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 9.003466396273001,
"density_atomic": 0.08532424068395064,
"volume": 11.719998818437753,
"volume_molar": 7.057948259166584,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0004985899999998,
"spacegroup": 225
},
{
"id": "oqmd-1277912",
"created_at": "2022-09-04T15:42:04.790397Z",
"updated_at": "2022-09-04T15:42:04.790423Z",
"structure_string": "Cu28\n1.0\n5.706258 -5.706258 0.000000\n5.706258 5.706258 0.000000\n-5.706258 0.000000 5.706258\nCu\n28\ndirect\n0.000000 0.000000 0.000000 Cu\n0.698170 0.060876 0.000000 Cu\n0.439126 0.198169 0.000000 Cu\n0.939125 0.301831 0.000000 Cu\n0.198169 0.439126 0.000000 Cu\n0.500000 0.500000 0.000000 Cu\n0.801832 0.560875 0.000000 Cu\n0.060876 0.698170 0.000000 Cu\n0.560875 0.801832 0.000000 Cu\n0.301831 0.939125 0.000000 Cu\n0.301831 0.301831 0.240956 Cu\n0.801832 0.439124 0.240956 Cu\n0.439124 0.801832 0.240956 Cu\n0.939125 0.939125 0.240956 Cu\n0.301831 0.060875 0.362706 Cu\n0.060875 0.301831 0.362706 Cu\n0.560875 0.560875 0.362706 Cu\n0.801832 0.801832 0.362706 Cu\n0.749999 0.249998 0.499999 Cu\n0.249998 0.749999 0.499999 Cu\n0.198169 0.198169 0.637291 Cu\n0.439124 0.439124 0.637291 Cu\n0.939124 0.698167 0.637291 Cu\n0.698167 0.939124 0.637291 Cu\n0.060875 0.060875 0.759043 Cu\n0.560876 0.198167 0.759043 Cu\n0.198167 0.560876 0.759043 Cu\n0.698167 0.698167 0.759043 Cu\n",
"nsites": 28,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 7.9508056986849915,
"density_atomic": 0.07534836353104488,
"volume": 371.60727436984746,
"volume_molar": 7.992397548911291,
"formula_full": "Cu28",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.23918831357143,
"spacegroup": 226
},
{
"id": "oqmd-594517",
"created_at": "2022-09-04T15:15:50.866559Z",
"updated_at": "2022-09-04T15:15:50.866586Z",
"structure_string": "Cu1\n1.0\n1.802470 -1.802470 0.000000\n-1.802470 0.000000 -1.802470\n1.802470 1.802470 0.000000\nCu\n1\ndirect\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cu"
],
"chemical_system": "Cu",
"density": 9.009551763773654,
"density_atomic": 0.08538191062332987,
"volume": 11.712082719858445,
"volume_molar": 7.0531810731751206,
"formula_full": "Cu1",
"formula_reduced": "Cu",
"formula_anonymous": "A",
"formation_energy": 0.0007944100000001,
"spacegroup": 225
}
]
}