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=23",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=formula_anonymous&page=21",
"results": [
{
"id": "oqmd-1215462",
"created_at": "2022-09-04T15:16:12.976268Z",
"updated_at": "2022-09-04T15:16:12.976299Z",
"structure_string": "Sm4\n1.0\n3.646240 0.000000 0.000000\n-1.823121 3.157737 0.000000\n0.000000 0.000000 11.702319\nSm\n4\ndirect\n0.000000 0.000000 0.000000 Sm\n0.333334 0.666667 0.250000 Sm\n0.000000 0.000000 0.500000 Sm\n0.666667 0.333334 0.750000 Sm\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Sm"
],
"chemical_system": "Sm",
"density": 7.412219407403147,
"density_atomic": 0.029687036865397226,
"volume": 134.73894407637366,
"volume_molar": 20.285422177042257,
"formula_full": "Sm4",
"formula_reduced": "Sm",
"formula_anonymous": "A",
"formation_energy": 0.0,
"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-1214586",
"created_at": "2022-09-04T15:16:14.902822Z",
"updated_at": "2022-09-04T15:16:14.902850Z",
"structure_string": "Y1\n1.0\n0.000000 2.527896 -2.527896\n2.527896 0.000000 2.527896\n0.000000 -2.527896 -2.527896\nY\n1\ndirect\n0.000000 0.000000 0.000000 Y\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Y"
],
"chemical_system": "Y",
"density": 4.569533148705819,
"density_atomic": 0.030952262239776367,
"volume": 32.307816218838845,
"volume_molar": 19.456221691805847,
"formula_full": "Y1",
"formula_reduced": "Y",
"formula_anonymous": "A",
"formation_energy": 0.0241223549999994,
"spacegroup": 225
},
{
"id": "oqmd-597628",
"created_at": "2022-09-04T15:15:50.256961Z",
"updated_at": "2022-09-04T15:15:50.256990Z",
"structure_string": "Ce1\n1.0\n2.648834 -2.648834 0.000000\n-2.648834 0.000000 -2.648834\n2.648834 2.648834 0.000000\nCe\n1\ndirect\n0.000000 0.000000 0.000000 Ce\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Ce"
],
"chemical_system": "Ce",
"density": 6.259542688328151,
"density_atomic": 0.026903313808107433,
"volume": 37.17014220376991,
"volume_molar": 22.3843828420319,
"formula_full": "Ce1",
"formula_reduced": "Ce",
"formula_anonymous": "A",
"formation_energy": 0.0063028724999991,
"spacegroup": 225
},
{
"id": "oqmd-604078",
"created_at": "2022-09-04T15:15:51.065743Z",
"updated_at": "2022-09-04T15:15:51.065769Z",
"structure_string": "Be2\n1.0\n2.268300 0.000000 0.000000\n-1.134150 1.964333 0.000000\n0.000000 0.000000 3.554150\nBe\n2\ndirect\n0.666688 0.333375 0.250001 Be\n0.333312 0.666623 0.749999 Be\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Be"
],
"chemical_system": "Be",
"density": 1.8899820888677814,
"density_atomic": 0.12629281318302155,
"volume": 15.836213871502185,
"volume_molar": 4.768395451982536,
"formula_full": "Be2",
"formula_reduced": "Be",
"formula_anonymous": "A",
"formation_energy": 0.0001101400000003,
"spacegroup": 194
},
{
"id": "oqmd-23200",
"created_at": "2022-09-04T15:15:44.405443Z",
"updated_at": "2022-09-04T15:15:44.405480Z",
"structure_string": "Ge34\n1.0\n7.791947 -7.791947 0.000000\n-7.791947 0.000000 -7.791947\n7.791947 7.791947 0.000000\nGe\n34\ndirect\n0.000000 0.000000 0.000000 Ge\n0.749999 0.500000 0.250000 Ge\n0.370925 0.117874 0.253051 Ge\n0.746949 0.117874 0.253051 Ge\n0.135177 0.506102 0.253051 Ge\n0.370925 0.506102 0.253051 Ge\n0.135177 0.882126 0.253051 Ge\n0.746949 0.882126 0.253051 Ge\n0.113053 0.226105 0.339158 Ge\n0.636948 0.273896 0.363052 Ge\n0.089157 0.726105 0.363052 Ge\n0.636948 0.726105 0.363052 Ge\n0.003051 0.006102 0.385177 Ge\n0.003051 0.382125 0.385177 Ge\n0.379074 0.382125 0.385177 Ge\n0.003051 0.006102 0.620925 Ge\n0.003051 0.617874 0.620925 Ge\n0.614823 0.617874 0.620925 Ge\n0.746949 0.493898 0.629075 Ge\n0.135177 0.882126 0.629075 Ge\n0.746949 0.882126 0.629075 Ge\n0.746949 0.117874 0.864823 Ge\n0.370925 0.117874 0.864824 Ge\n0.746949 0.493898 0.864824 Ge\n0.113053 0.226105 0.886948 Ge\n0.113053 0.773895 0.886948 Ge\n0.660843 0.773895 0.886948 Ge\n0.636947 0.273896 0.910843 Ge\n0.003051 0.382125 0.996949 Ge\n0.379075 0.382125 0.996949 Ge\n0.003051 0.617874 0.996949 Ge\n0.614823 0.617874 0.996949 Ge\n0.379075 0.993898 0.996949 Ge\n0.614823 0.993898 0.996949 Ge\n",
"nsites": 34,
"nelements": 1,
"elements": [
"Ge"
],
"chemical_system": "Ge",
"density": 4.334468835851914,
"density_atomic": 0.035934445840245216,
"volume": 946.1673668533742,
"volume_molar": 16.75868548738111,
"formula_full": "Ge34",
"formula_reduced": "Ge",
"formula_anonymous": "A",
"formation_energy": 0.30048459529412,
"spacegroup": 227
},
{
"id": "oqmd-40867",
"created_at": "2022-09-04T15:15:50.961982Z",
"updated_at": "2022-09-04T15:15:50.961999Z",
"structure_string": "H2\n1.0\n3.579711 0.000000 0.000000\n-1.789855 3.104049 0.000000\n0.000000 0.000000 0.969201\nH\n2\ndirect\n0.333435 0.666871 0.250000 H\n0.666566 0.333129 0.749999 H\n",
"nsites": 2,
"nelements": 1,
"elements": [
"H"
],
"chemical_system": "H",
"density": 0.31083032709645825,
"density_atomic": 0.18571184623078654,
"volume": 10.769372232262308,
"volume_molar": 3.2427337739759516,
"formula_full": "H2",
"formula_reduced": "H",
"formula_anonymous": "A",
"formation_energy": 0.387579205,
"spacegroup": 194
},
{
"id": "oqmd-636456",
"created_at": "2022-09-04T15:15:50.423976Z",
"updated_at": "2022-09-04T15:15:50.424005Z",
"structure_string": "Ca2\n1.0\n3.799722 0.000000 0.000000\n-1.899861 3.290552 0.000000\n0.000000 0.000000 6.342060\nCa\n2\ndirect\n0.333301 0.666602 0.249999 Ca\n0.666698 0.333397 0.749999 Ca\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ca"
],
"chemical_system": "Ca",
"density": 1.67854970480088,
"density_atomic": 0.025221973647538837,
"volume": 79.29593567691164,
"volume_molar": 23.876564317113388,
"formula_full": "Ca2",
"formula_reduced": "Ca",
"formula_anonymous": "A",
"formation_energy": 0.0077848099999999,
"spacegroup": 194
},
{
"id": "oqmd-594005",
"created_at": "2022-09-04T15:15:50.833618Z",
"updated_at": "2022-09-04T15:15:50.833647Z",
"structure_string": "Au1\n1.0\n2.062721 -2.062721 0.000000\n-2.062721 0.000000 -2.062721\n2.062721 2.062721 0.000000\nAu\n1\ndirect\n0.000000 0.000000 0.000000 Au\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Au"
],
"chemical_system": "Au",
"density": 18.633316103842542,
"density_atomic": 0.05697030364665223,
"volume": 17.553004565366457,
"volume_molar": 10.570666425355943,
"formula_full": "Au1",
"formula_reduced": "Au",
"formula_anonymous": "A",
"formation_energy": 0.0048540699999999,
"spacegroup": 225
},
{
"id": "oqmd-47818",
"created_at": "2022-09-04T15:16:14.246197Z",
"updated_at": "2022-09-04T15:16:14.246213Z",
"structure_string": "O2\n1.0\n-0.903613 1.283957 -1.755654\n0.903613 1.283957 1.755654\n3.057582 -1.283957 -2.222564\nO\n2\ndirect\n0.058035 0.106025 0.164060 O\n0.941965 0.893977 0.835939 O\n",
"nsites": 2,
"nelements": 1,
"elements": [
"O"
],
"chemical_system": "O",
"density": 2.8051637672864933,
"density_atomic": 0.10558577863725538,
"volume": 18.941944888914335,
"volume_molar": 5.703552919460235,
"formula_full": "O2",
"formula_reduced": "O",
"formula_anonymous": "A",
"formation_energy": 0.0763565762500003,
"spacegroup": 12
},
{
"id": "oqmd-632879",
"created_at": "2022-09-04T15:16:17.698626Z",
"updated_at": "2022-09-04T15:16:17.698651Z",
"structure_string": "Ca2\n1.0\n3.872602 0.000000 0.000000\n0.000000 -5.048768 0.000000\n0.000000 0.000000 -3.978799\nCa\n2\ndirect\n0.749168 0.250002 0.385199 Ca\n0.250834 0.750001 0.885199 Ca\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Ca"
],
"chemical_system": "Ca",
"density": 1.7109796887055542,
"density_atomic": 0.025709268243042538,
"volume": 77.79295704152301,
"volume_molar": 23.424006872034237,
"formula_full": "Ca2",
"formula_reduced": "Ca",
"formula_anonymous": "A",
"formation_energy": 0.0151147249999999,
"spacegroup": 139
},
{
"id": "oqmd-1215409",
"created_at": "2022-09-04T15:39:05.048926Z",
"updated_at": "2022-09-04T15:39:05.048952Z",
"structure_string": "Cr4\n1.0\n2.486024 0.000000 0.000000\n-1.243012 2.152959 0.000000\n0.000000 0.000000 8.622400\nCr\n4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.333334 0.666668 0.250000 Cr\n0.000000 0.000000 0.500000 Cr\n0.666665 0.333332 0.750000 Cr\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Cr"
],
"chemical_system": "Cr",
"density": 7.483600864507536,
"density_atomic": 0.08667438098875946,
"volume": 46.14973830062597,
"volume_molar": 6.94800550208832,
"formula_full": "Cr4",
"formula_reduced": "Cr",
"formula_anonymous": "A",
"formation_energy": 0.3960388975,
"spacegroup": 194
}
]
}