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=12",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=elements&page=10",
"results": [
{
"id": "oqmd-686254",
"created_at": "2022-09-04T15:39:32.055921Z",
"updated_at": "2022-09-04T15:39:32.055948Z",
"structure_string": "As1\n1.0\n1.930368 1.114498 -1.576139\n0.000000 2.228996 1.576139\n1.930368 -1.114498 1.576139\nAs\n1\ndirect\n0.500001 0.500001 0.500000 As\n",
"nsites": 1,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 6.1149227100325545,
"density_atomic": 0.04915127988332152,
"volume": 20.345350159219954,
"volume_molar": 12.252256247031099,
"formula_full": "As1",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.110996655,
"spacegroup": 221
},
{
"id": "oqmd-1215217",
"created_at": "2022-09-04T15:39:04.241859Z",
"updated_at": "2022-09-04T15:39:04.241886Z",
"structure_string": "As2\n1.0\n2.992744 0.000000 0.000000\n1.496372 2.446000 0.000000\n0.000000 0.000000 5.468258\nAs\n2\ndirect\n0.995908 0.008181 0.249999 As\n0.004092 0.991815 0.749999 As\n",
"nsites": 2,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 6.216001607419676,
"density_atomic": 0.049963744310324146,
"volume": 40.029025598602594,
"volume_molar": 12.053021332021403,
"formula_full": "As2",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.278811924999999,
"spacegroup": 65
},
{
"id": "oqmd-1214950",
"created_at": "2022-09-04T15:39:04.129354Z",
"updated_at": "2022-09-04T15:39:04.129379Z",
"structure_string": "As8\n1.0\n5.385087 0.000000 0.000000\n0.000000 5.385087 0.000000\n0.000000 0.000000 5.385087\nAs\n8\ndirect\n0.000000 0.000000 0.000000 As\n0.500001 0.250000 0.000000 As\n0.500001 0.749999 0.000000 As\n0.000000 0.500001 0.250000 As\n0.250000 0.000000 0.500001 As\n0.749999 0.000000 0.500001 As\n0.500001 0.500001 0.500001 As\n0.000000 0.500001 0.749999 As\n",
"nsites": 8,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 6.373352742415618,
"density_atomic": 0.051228520668569026,
"volume": 156.1630102840029,
"volume_molar": 11.755445367944912,
"formula_full": "As8",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.5827630875,
"spacegroup": 223
},
{
"id": "oqmd-594530",
"created_at": "2022-09-04T15:15:51.097488Z",
"updated_at": "2022-09-04T15:15:51.097525Z",
"structure_string": "As2\n1.0\n4.130347 -0.038677 -0.026243\n2.389415 3.369266 -0.026243\n2.389415 1.220621 3.140498\nAs\n2\ndirect\n0.228147 0.228146 0.228147 As\n0.771854 0.771855 0.771853 As\n",
"nsites": 2,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 5.621332850223511,
"density_atomic": 0.045183842436035355,
"volume": 44.26361044506797,
"volume_molar": 13.328084632300278,
"formula_full": "As2",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.0013871999999999,
"spacegroup": 166
},
{
"id": "oqmd-1214861",
"created_at": "2022-09-04T15:39:03.656572Z",
"updated_at": "2022-09-04T15:39:03.656606Z",
"structure_string": "As20\n1.0\n7.670514 0.000000 0.000000\n0.000000 7.670514 0.000000\n0.000000 0.000000 7.670514\nAs\n20\ndirect\n0.497578 0.502423 0.002422 As\n0.875000 0.693025 0.056974 As\n0.193026 0.443026 0.125001 As\n0.443026 0.125001 0.193026 As\n0.252422 0.747577 0.247578 As\n0.747577 0.247578 0.252422 As\n0.556974 0.625000 0.306974 As\n0.806975 0.943025 0.375001 As\n0.125001 0.193026 0.443026 As\n0.502423 0.002422 0.497578 As\n0.002422 0.497578 0.502423 As\n0.625000 0.306974 0.556974 As\n0.306974 0.556974 0.625000 As\n0.056974 0.875000 0.693025 As\n0.247578 0.252422 0.747577 As\n0.752423 0.752423 0.752423 As\n0.943025 0.375001 0.806975 As\n0.693025 0.056974 0.875000 As\n0.375001 0.806975 0.943025 As\n0.997579 0.997579 0.997579 As\n",
"nsites": 20,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 5.513314104124148,
"density_atomic": 0.04431559603719462,
"volume": 451.3083832430857,
"volume_molar": 13.589213050289437,
"formula_full": "As20",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.350411831,
"spacegroup": 213
},
{
"id": "oqmd-1215663",
"created_at": "2022-09-04T15:39:05.231507Z",
"updated_at": "2022-09-04T15:39:05.231520Z",
"structure_string": "As1\n1.0\n0.000000 -2.731321 -0.000000\n-2.731321 0.000000 -0.000000\n1.365660 1.365660 -2.660822\nAs\n1\ndirect\n0.000000 0.000000 0.000000 As\n",
"nsites": 1,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 6.267507041363145,
"density_atomic": 0.050377741039197586,
"volume": 19.85003653145,
"volume_molar": 11.953971408353409,
"formula_full": "As1",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.478572355,
"spacegroup": 139
},
{
"id": "oqmd-1214951",
"created_at": "2022-09-04T15:39:03.849945Z",
"updated_at": "2022-09-04T15:39:03.849973Z",
"structure_string": "Au8\n1.0\n5.262732 0.000000 0.000000\n0.000000 5.262732 0.000000\n0.000000 0.000000 5.262732\nAu\n8\ndirect\n0.000000 0.000000 0.000000 Au\n0.500001 0.249999 0.000000 Au\n0.500001 0.750000 0.000000 Au\n0.000000 0.500001 0.249999 Au\n0.249999 0.000000 0.500001 Au\n0.750000 0.000000 0.500001 Au\n0.500001 0.500001 0.500001 Au\n0.000000 0.500001 0.750000 Au\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 17.951380022133076,
"density_atomic": 0.054885322882837206,
"volume": 145.75845744913386,
"volume_molar": 10.972224346489432,
"formula_full": "Au8",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.12478556875,
"spacegroup": 223
},
{
"id": "oqmd-1522144",
"created_at": "2022-09-04T15:54:09.645353Z",
"updated_at": "2022-09-04T15:54:09.645380Z",
"structure_string": "Au1\n1.0\n-1.651917 1.651917 1.651917\n1.651917 -1.651917 1.651917\n1.651917 1.651917 -1.651917\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.139151094584225,
"density_atomic": 0.055459422251622856,
"volume": 18.031201180981252,
"volume_molar": 10.858643158374734,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.0182637200000002,
"spacegroup": 229
},
{
"id": "oqmd-1522147",
"created_at": "2022-09-04T15:54:09.876589Z",
"updated_at": "2022-09-04T15:54:09.876606Z",
"structure_string": "Au1\n1.0\n-1.651917 1.651917 1.651917\n1.651917 -1.651917 1.651917\n1.651917 1.651917 -1.651917\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.139151094584225,
"density_atomic": 0.055459422251622856,
"volume": 18.031201180981252,
"volume_molar": 10.858643158374734,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.0182637200000002,
"spacegroup": 229
},
{
"id": "oqmd-1215040",
"created_at": "2022-09-04T15:39:03.860861Z",
"updated_at": "2022-09-04T15:39:03.860890Z",
"structure_string": "Au4\n1.0\n0.000000 0.000000 3.232688\n4.451135 -0.000000 0.000000\n2.225567 5.138720 0.000000\nAu\n4\ndirect\n0.000139 0.366711 0.266580 Au\n0.499860 0.866709 0.266580 Au\n0.500141 0.133291 0.733420 Au\n0.999861 0.633289 0.733420 Au\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 17.693432635241404,
"density_atomic": 0.054096663426077995,
"volume": 73.94171371522607,
"volume_molar": 11.13218520071785,
"formula_full": "Au4",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.117989535,
"spacegroup": 69
},
{
"id": "oqmd-629973",
"created_at": "2022-09-04T15:15:51.520231Z",
"updated_at": "2022-09-04T15:15:51.520255Z",
"structure_string": "Au1\n1.0\n2.061742 -2.061742 0.000000\n-2.061742 0.000000 -2.061742\n2.061742 2.061742 0.000000\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.659872307136567,
"density_atomic": 0.05705149772702588,
"volume": 17.528023624983465,
"volume_molar": 10.555622551425587,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.0056917200000001,
"spacegroup": 225
},
{
"id": "oqmd-636382",
"created_at": "2022-09-04T15:15:51.407825Z",
"updated_at": "2022-09-04T15:15:51.407837Z",
"structure_string": "Au1\n1.0\n2.069548 -2.069548 0.000000\n-2.069548 0.000000 -2.069548\n2.069548 2.069548 0.000000\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.449521662521473,
"density_atomic": 0.056408362601254064,
"volume": 17.727867888470993,
"volume_molar": 10.67597157990563,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 225
}
]
}