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=nelements&page=39",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=nelements&page=37",
"results": [
{
"id": "oqmd-106266",
"created_at": "2022-09-04T15:16:10.061674Z",
"updated_at": "2022-09-04T15:16:10.061697Z",
"structure_string": "Se3\n1.0\n4.216769 0.000000 0.000000\n-2.108385 3.651829 0.000000\n0.000000 0.000000 5.128422\nSe\n3\ndirect\n0.762466 0.762467 0.000000 Se\n0.237530 0.000000 0.333368 Se\n0.000000 0.237530 0.666700 Se\n",
"nsites": 3,
"nelements": 1,
"elements": [
"Se"
],
"chemical_system": "Se",
"density": 4.980850351998228,
"density_atomic": 0.037988072358909115,
"volume": 78.97215661948238,
"volume_molar": 15.852714776109622,
"formula_full": "Se3",
"formula_reduced": "Se",
"formula_anonymous": "A",
"formation_energy": 0.0072743666666701,
"spacegroup": 152
},
{
"id": "oqmd-620952",
"created_at": "2022-09-04T15:16:11.378941Z",
"updated_at": "2022-09-04T15:16:11.378958Z",
"structure_string": "Ba1\n1.0\n0.000000 0.000000 -3.960113\n-2.798897 -2.798897 0.000000\n-2.798897 2.798897 0.000000\nBa\n1\ndirect\n0.000000 0.000000 0.000000 Ba\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ba"
],
"chemical_system": "Ba",
"density": 3.67530700852149,
"density_atomic": 0.016117162793317916,
"volume": 62.04565982386145,
"volume_molar": 37.36476970063705,
"formula_full": "Ba1",
"formula_reduced": "Ba",
"formula_anonymous": "A",
"formation_energy": 0.30703454,
"spacegroup": 221
},
{
"id": "oqmd-1215197",
"created_at": "2022-09-04T15:16:14.442093Z",
"updated_at": "2022-09-04T15:16:14.442108Z",
"structure_string": "Ta1\n1.0\n1.657966 1.657966 1.657966\n1.657966 -1.657966 -1.657966\n-1.657966 1.657966 -1.657966\nTa\n1\ndirect\n0.000000 0.000000 0.000000 Ta\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ta"
],
"chemical_system": "Ta",
"density": 16.48222144538594,
"density_atomic": 0.054854612066140986,
"volume": 18.23000769368762,
"volume_molar": 10.978367238726982,
"formula_full": "Ta1",
"formula_reduced": "Ta",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 229
},
{
"id": "oqmd-1214631",
"created_at": "2022-09-04T15:16:14.603462Z",
"updated_at": "2022-09-04T15:16:14.603485Z",
"structure_string": "Mg1\n1.0\n-1.599726 0.923602 2.605210\n-1.599726 -0.923602 -2.605210\n0.000000 -1.847204 2.605210\nMg\n1\ndirect\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Mg"
],
"chemical_system": "Mg",
"density": 1.7475124073561226,
"density_atomic": 0.04329876856853248,
"volume": 23.095345042370404,
"volume_molar": 13.908341874592272,
"formula_full": "Mg1",
"formula_reduced": "Mg",
"formula_anonymous": "A",
"formation_energy": 0.0127010808333299,
"spacegroup": 225
},
{
"id": "oqmd-1215341",
"created_at": "2022-09-04T15:16:14.569998Z",
"updated_at": "2022-09-04T15:16:14.570028Z",
"structure_string": "Li2\n1.0\n2.938609 0.000000 0.000000\n-1.469304 2.544910 0.000000\n0.000000 0.000000 4.774389\nLi\n2\ndirect\n0.333334 0.666668 0.250001 Li\n0.666664 0.333332 0.750000 Li\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Li"
],
"chemical_system": "Li",
"density": 0.6456082984821788,
"density_atomic": 0.05601417736100512,
"volume": 35.705246318449404,
"volume_molar": 10.751100960008706,
"formula_full": "Li2",
"formula_reduced": "Li",
"formula_anonymous": "A",
"formation_energy": 0.0045293899999998,
"spacegroup": 194
},
{
"id": "oqmd-1214523",
"created_at": "2022-09-04T15:16:14.572630Z",
"updated_at": "2022-09-04T15:16:14.572655Z",
"structure_string": "Eu1\n1.0\n0.000000 2.731077 -2.731077\n2.731077 0.000000 2.731077\n0.000000 -2.731077 -2.731077\nEu\n1\ndirect\n0.000000 0.000000 0.000000 Eu\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Eu"
],
"chemical_system": "Eu",
"density": 6.193811497538729,
"density_atomic": 0.02454529012922449,
"volume": 40.74101364193551,
"volume_molar": 24.53481188568159,
"formula_full": "Eu1",
"formula_reduced": "Eu",
"formula_anonymous": "A",
"formation_energy": 0.02162529,
"spacegroup": 225
},
{
"id": "oqmd-1215154",
"created_at": "2022-09-04T15:16:14.781665Z",
"updated_at": "2022-09-04T15:16:14.781692Z",
"structure_string": "Hf1\n1.0\n1.764872 1.764872 1.764872\n1.764872 -1.764872 -1.764872\n-1.764872 1.764872 -1.764872\nHf\n1\ndirect\n0.000000 0.000000 0.000000 Hf\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Hf"
],
"chemical_system": "Hf",
"density": 13.479176392823518,
"density_atomic": 0.04547789657375993,
"volume": 21.98870386140473,
"volume_molar": 13.241906978333484,
"formula_full": "Hf1",
"formula_reduced": "Hf",
"formula_anonymous": "A",
"formation_energy": 0.179675254999999,
"spacegroup": 229
},
{
"id": "oqmd-1215142",
"created_at": "2022-09-04T15:16:14.830137Z",
"updated_at": "2022-09-04T15:16:14.830161Z",
"structure_string": "Cs1\n1.0\n3.070816 3.070816 3.070816\n3.070816 -3.070816 -3.070816\n-3.070816 3.070816 -3.070816\nCs\n1\ndirect\n0.000000 0.000000 0.000000 Cs\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Cs"
],
"chemical_system": "Cs",
"density": 1.9053313718310307,
"density_atomic": 0.008633335619827645,
"volume": 115.83008515310841,
"volume_molar": 69.7545077034805,
"formula_full": "Cs1",
"formula_reduced": "Cs",
"formula_anonymous": "A",
"formation_energy": 0.0020204799999999,
"spacegroup": 229
},
{
"id": "oqmd-1214559",
"created_at": "2022-09-04T15:16:14.870376Z",
"updated_at": "2022-09-04T15:16:14.870403Z",
"structure_string": "Pr1\n1.0\n0.000000 2.620434 -2.620434\n2.620434 0.000000 2.620434\n0.000000 -2.620434 -2.620434\nPr\n1\ndirect\n0.000000 0.000000 0.000000 Pr\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Pr"
],
"chemical_system": "Pr",
"density": 6.5018058444222575,
"density_atomic": 0.02778755447474467,
"volume": 35.98733385871981,
"volume_molar": 21.672079007432462,
"formula_full": "Pr1",
"formula_reduced": "Pr",
"formula_anonymous": "A",
"formation_energy": 0.0062614324999996,
"spacegroup": 225
},
{
"id": "oqmd-1215377",
"created_at": "2022-09-04T15:16:14.903376Z",
"updated_at": "2022-09-04T15:16:14.903406Z",
"structure_string": "Tc2\n1.0\n2.752709 0.000000 0.000000\n-1.376355 2.383916 0.000000\n0.000000 0.000000 4.412950\nTc\n2\ndirect\n0.333334 0.666668 0.250001 Tc\n0.666665 0.333334 0.749999 Tc\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Tc"
],
"chemical_system": "Tc",
"density": 11.238928563040833,
"density_atomic": 0.06906368349143471,
"volume": 28.958779765171954,
"volume_molar": 8.719692399185263,
"formula_full": "Tc2",
"formula_reduced": "Tc",
"formula_anonymous": "A",
"formation_energy": 0.0,
"spacegroup": 194
},
{
"id": "oqmd-1214594",
"created_at": "2022-09-04T15:16:15.051344Z",
"updated_at": "2022-09-04T15:16:15.051383Z",
"structure_string": "As1\n1.0\n0.000000 -2.227666 1.578824\n-1.929215 1.113833 1.578824\n-1.929215 -1.113833 -1.578824\nAs\n1\ndirect\n0.000000 0.000000 0.000000 As\n",
"nsites": 1,
"nelements": 1,
"elements": [
"As"
],
"chemical_system": "As",
"density": 6.111818661891277,
"density_atomic": 0.04912632978236393,
"volume": 20.355683081356393,
"volume_molar": 12.258478878187873,
"formula_full": "As1",
"formula_reduced": "As",
"formula_anonymous": "A",
"formation_energy": 0.110932105,
"spacegroup": 221
},
{
"id": "oqmd-760769",
"created_at": "2022-09-04T15:21:53.153898Z",
"updated_at": "2022-09-04T15:21:53.153925Z",
"structure_string": "Zn4\n1.0\n0.000000 -2.718078 0.000000\n-4.705679 0.000000 0.000000\n0.000000 0.000000 -4.507286\nZn\n4\ndirect\n0.000000 0.000157 0.000000 Zn\n0.500000 0.500162 0.000000 Zn\n0.500000 0.166518 0.500004 Zn\n0.000000 0.666514 0.500004 Zn\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Zn"
],
"chemical_system": "Zn",
"density": 7.53611068562195,
"density_atomic": 0.06938421218400993,
"volume": 57.65000241541731,
"volume_molar": 8.679410733999577,
"formula_full": "Zn4",
"formula_reduced": "Zn",
"formula_anonymous": "A",
"formation_energy": 0.0157037425,
"spacegroup": 194
}
]
}