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=formula_anonymous&page=15",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=formula_anonymous&page=13",
"results": [
{
"id": "oqmd-752499",
"created_at": "2022-09-04T15:22:07.712150Z",
"updated_at": "2022-09-04T15:22:07.712178Z",
"structure_string": "Mg10\n1.0\n2.772990 4.790246 0.000000\n-5.517797 6.370762 0.000000\n0.000000 0.000000 5.193711\nMg\n10\ndirect\n0.000000 0.000000 0.000000 Mg\n0.399903 0.199999 0.000000 Mg\n0.799894 0.399993 0.000000 Mg\n0.199894 0.599997 0.000000 Mg\n0.599901 0.799995 0.000000 Mg\n0.666741 0.000000 0.500001 Mg\n0.066747 0.200007 0.500001 Mg\n0.466738 0.400002 0.500001 Mg\n0.866729 0.600006 0.500001 Mg\n0.266735 0.800001 0.500001 Mg\n",
"nsites": 10,
"nelements": 1,
"elements": [
"Mg"
],
"chemical_system": "Mg",
"density": 1.762184413603215,
"density_atomic": 0.043662302355334054,
"volume": 229.03052428654942,
"volume_molar": 13.792540555901992,
"formula_full": "Mg10",
"formula_reduced": "Mg",
"formula_anonymous": "A",
"formation_energy": 0.00035486183333,
"spacegroup": 194
},
{
"id": "oqmd-760762",
"created_at": "2022-09-04T15:22:07.388508Z",
"updated_at": "2022-09-04T15:22:07.388535Z",
"structure_string": "Zn8\n1.0\n9.299243 0.000000 0.000000\n0.000000 2.710265 0.000000\n0.000000 0.000000 4.617999\nZn\n8\ndirect\n0.000000 0.000000 0.000000 Zn\n0.499958 0.000000 0.000000 Zn\n0.249969 0.499999 0.000000 Zn\n0.749969 0.499999 0.000000 Zn\n0.166747 0.000000 0.500000 Zn\n0.666742 0.000000 0.500000 Zn\n0.416744 0.499999 0.500000 Zn\n0.916743 0.499999 0.500000 Zn\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Zn"
],
"chemical_system": "Zn",
"density": 7.465577465888701,
"density_atomic": 0.06873481993273499,
"volume": 116.3893352427333,
"volume_molar": 8.761411997432107,
"formula_full": "Zn8",
"formula_reduced": "Zn",
"formula_anonymous": "A",
"formation_energy": 0.0096946137499998,
"spacegroup": 194
},
{
"id": "oqmd-1215354",
"created_at": "2022-09-04T15:16:13.120640Z",
"updated_at": "2022-09-04T15:16:13.120662Z",
"structure_string": "Os2\n1.0\n2.750142 0.000000 0.000000\n-1.375071 2.381693 0.000000\n0.000000 0.000000 4.348155\nOs\n2\ndirect\n0.333334 0.666669 0.250000 Os\n0.666667 0.333334 0.750001 Os\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Os"
],
"chemical_system": "Os",
"density": 22.182586568223943,
"density_atomic": 0.07022376006985998,
"volume": 28.4803889454276,
"volume_molar": 8.575645556445648,
"formula_full": "Os2",
"formula_reduced": "Os",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 194
},
{
"id": "oqmd-1215579",
"created_at": "2022-09-04T15:16:19.930392Z",
"updated_at": "2022-09-04T15:16:19.930420Z",
"structure_string": "Bi2\n1.0\n0.000000 0.000000 -3.353767\n-3.164148 -3.164148 1.676884\n-3.164148 3.164148 -1.676884\nBi\n2\ndirect\n0.000000 0.000000 0.000000 Bi\n0.250002 0.500000 0.500000 Bi\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Bi"
],
"chemical_system": "Bi",
"density": 10.334945444897233,
"density_atomic": 0.029781977753703337,
"volume": 67.15470733810831,
"volume_molar": 20.22075501433466,
"formula_full": "Bi2",
"formula_reduced": "Bi",
"formula_anonymous": "A",
"formation_energy": 0.0424597650000003,
"spacegroup": 141
},
{
"id": "oqmd-1215204",
"created_at": "2022-09-04T15:16:16.479962Z",
"updated_at": "2022-09-04T15:16:16.479996Z",
"structure_string": "Tm1\n1.0\n1.960106 1.960106 -1.960106\n1.960106 -1.960106 1.960106\n-1.960106 -1.960106 -1.960106\nTm\n1\ndirect\n0.000000 0.000000 0.000000 Tm\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Tm"
],
"chemical_system": "Tm",
"density": 9.312537554532652,
"density_atomic": 0.033197190791351465,
"volume": 30.123030779475478,
"volume_molar": 18.140513147181384,
"formula_full": "Tm1",
"formula_reduced": "Tm",
"formula_anonymous": "A",
"formation_energy": 0.14324681,
"spacegroup": 229
},
{
"id": "oqmd-592420",
"created_at": "2022-09-04T15:15:49.914999Z",
"updated_at": "2022-09-04T15:15:49.915019Z",
"structure_string": "Ce4\n1.0\n3.778569 0.000000 0.000000\n-1.889285 3.272311 0.000000\n0.000000 0.000000 12.147338\nCe\n4\ndirect\n0.000000 0.000000 0.000000 Ce\n0.333304 0.666608 0.250000 Ce\n0.000000 0.000000 0.500000 Ce\n0.666699 0.333394 0.750000 Ce\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Ce"
],
"chemical_system": "Ce",
"density": 6.196319085570395,
"density_atomic": 0.02663158079025572,
"volume": 150.19761806492417,
"volume_molar": 22.612779945092306,
"formula_full": "Ce4",
"formula_reduced": "Ce",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 194
},
{
"id": "oqmd-599493",
"created_at": "2022-09-04T15:15:49.822027Z",
"updated_at": "2022-09-04T15:15:49.822055Z",
"structure_string": "C10\n1.0\n1.256468 -2.176267 0.000000\n-2.512936 0.000000 0.000000\n1.256468 -0.725423 -10.337881\nC\n10\ndirect\n0.975244 0.024758 0.074273 C\n0.625234 0.374763 0.124291 C\n0.574784 0.425213 0.275643 C\n0.891441 0.108560 0.325682 C\n0.841673 0.158329 0.474986 C\n0.158328 0.841671 0.525014 C\n0.108559 0.891440 0.674318 C\n0.425212 0.574785 0.724357 C\n0.374761 0.625235 0.875708 C\n0.024756 0.975243 0.925727 C\n",
"nsites": 10,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.527705186022003,
"density_atomic": 0.17687842671408055,
"volume": 56.536007164767156,
"volume_molar": 3.404677931545963,
"formula_full": "C10",
"formula_reduced": "C",
"formula_anonymous": "A",
"formation_energy": 0.135417882500001,
"spacegroup": 166
},
{
"id": "oqmd-116613",
"created_at": "2022-09-04T15:15:51.030844Z",
"updated_at": "2022-09-04T15:15:51.030874Z",
"structure_string": "Mg2\n1.0\n3.184773 0.000000 0.000000\n-1.592387 2.758043 0.000000\n0.000000 0.000000 5.201286\nMg\n2\ndirect\n0.333303 0.666607 0.250000 Mg\n0.666697 0.333392 0.749999 Mg\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Mg"
],
"chemical_system": "Mg",
"density": 1.7667881112862882,
"density_atomic": 0.04377636989482607,
"volume": 45.6867484628135,
"volume_molar": 13.756601505488824,
"formula_full": "Mg2",
"formula_reduced": "Mg",
"formula_anonymous": "A",
"formation_energy": 0.00031509083333,
"spacegroup": 194
},
{
"id": "oqmd-620947",
"created_at": "2022-09-04T15:15:50.032599Z",
"updated_at": "2022-09-04T15:15:50.032623Z",
"structure_string": "Cs8\n1.0\n-7.967607 -5.358462 0.000000\n7.967607 -5.358462 0.000000\n0.000000 0.000000 10.725576\nCs\n8\ndirect\n0.754872 0.245127 0.000000 Cs\n0.245127 0.754872 0.000000 Cs\n0.273855 0.273855 0.226932 Cs\n0.773855 0.773855 0.273066 Cs\n0.745127 0.254872 0.499999 Cs\n0.254872 0.745127 0.499999 Cs\n0.226145 0.226145 0.726934 Cs\n0.726145 0.726145 0.773066 Cs\n",
"nsites": 8,
"nelements": 1,
"elements": [
"Cs"
],
"chemical_system": "Cs",
"density": 1.9278054377912888,
"density_atomic": 0.008735168905651616,
"volume": 915.8380434777895,
"volume_molar": 68.94132013982811,
"formula_full": "Cs8",
"formula_reduced": "Cs",
"formula_anonymous": "A",
"formation_energy": 0.0038103649999999,
"spacegroup": 64
},
{
"id": "oqmd-589216",
"created_at": "2022-09-04T15:15:50.039745Z",
"updated_at": "2022-09-04T15:15:50.039774Z",
"structure_string": "C4\n1.0\n2.505919 0.000000 0.000000\n-1.252960 2.170143 0.000000\n0.000000 0.000000 4.168506\nC\n4\ndirect\n0.333342 0.666684 0.062768 C\n0.333342 0.666684 0.437231 C\n0.666657 0.333314 0.562770 C\n0.666657 0.333314 0.937230 C\n",
"nsites": 4,
"nelements": 1,
"elements": [
"C"
],
"chemical_system": "C",
"density": 3.5191809331432706,
"density_atomic": 0.17645102239353888,
"volume": 22.669180069009723,
"volume_molar": 3.412924832234077,
"formula_full": "C4",
"formula_reduced": "C",
"formula_anonymous": "A",
"formation_energy": 0.152669772499999,
"spacegroup": 194
},
{
"id": "oqmd-594522",
"created_at": "2022-09-04T15:15:50.116527Z",
"updated_at": "2022-09-04T15:15:50.116548Z",
"structure_string": "Au1\n1.0\n2.061997 -2.061997 0.000000\n-2.061997 0.000000 -2.061997\n2.061997 2.061997 0.000000\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.652950358621347,
"density_atomic": 0.05703033426333853,
"volume": 17.534528122919344,
"volume_molar": 10.559539651639886,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.0054697599999999,
"spacegroup": 225
},
{
"id": "oqmd-1216093",
"created_at": "2022-09-04T15:39:06.287944Z",
"updated_at": "2022-09-04T15:39:06.287970Z",
"structure_string": "Tc3\n1.0\n-2.751074 0.000000 0.000000\n1.375537 2.382501 0.000000\n-1.375537 -0.794167 -6.625869\nTc\n3\ndirect\n0.000000 0.000000 0.000000 Tc\n0.221692 0.778306 0.334922 Tc\n0.778306 0.221693 0.665078 Tc\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.241343498530544,
"density_atomic": 0.06907852337046572,
"volume": 43.428837989357476,
"volume_molar": 8.71781918050487,
"formula_full": "Tc3",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"formation_energy": 0.0155488350000006,
"spacegroup": 166
}
]
}