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=-density&page=69",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-density&page=67",
"results": [
{
"id": "oqmd-1625874",
"created_at": "2022-09-04T15:59:04.208367Z",
"updated_at": "2022-09-04T15:59:04.208393Z",
"structure_string": "Re6 Pt1 Rh1\n1.0\n5.556603 0.000000 0.000000\n-2.778301 4.812159 0.000000\n0.000000 0.000000 4.406603\nPt Re Rh\n1 6 1\ndirect\n0.000000 0.000000 0.000000 Pt\n0.013443 0.506722 0.000000 Re\n0.493278 0.506722 0.000000 Re\n0.493278 0.986557 0.000000 Re\n0.174380 0.348759 0.500000 Re\n0.174380 0.825620 0.500000 Re\n0.651241 0.825620 0.500000 Re\n0.666667 0.333333 0.500000 Rh\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pt",
"Re",
"Rh"
],
"chemical_system": "Pt-Re-Rh",
"density": 19.94450768410748,
"density_atomic": 0.06789483286888617,
"volume": 117.82929071272699,
"volume_molar": 8.869807179037533,
"formula_full": "Re6 Pt1 Rh1",
"formula_reduced": "Re6PtRh",
"formula_anonymous": "ABC6",
"formation_energy": -0.2028660250000005,
"spacegroup": 187
},
{
"id": "oqmd-542801",
"created_at": "2022-09-04T15:13:04.051164Z",
"updated_at": "2022-09-04T15:13:04.051193Z",
"structure_string": "Ta1 Re2 Os1\n1.0\n0.000000 3.140010 3.140010\n3.140010 0.000000 3.140010\n3.140010 3.140010 0.000000\nOs Re Ta\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Os\n0.000000 0.000000 0.000000 Re\n0.500000 0.500000 0.500000 Re\n0.749999 0.749999 0.749999 Ta\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Os",
"Re",
"Ta"
],
"chemical_system": "Os-Re-Ta",
"density": 19.941629673602296,
"density_atomic": 0.06460065213177255,
"volume": 61.91887957788401,
"volume_molar": 9.322105212987672,
"formula_full": "Ta1 Re2 Os1",
"formula_reduced": "TaRe2Os",
"formula_anonymous": "ABC2",
"formation_energy": 0.194061895000001,
"spacegroup": 225
},
{
"id": "oqmd-325069",
"created_at": "2022-09-04T14:51:12.536893Z",
"updated_at": "2022-09-04T14:51:12.536914Z",
"structure_string": "Pt2 Au6\n1.0\n5.689338 0.000000 0.000000\n-2.844669 4.927111 0.000000\n0.000000 0.000000 4.669944\nAu Pt\n6 2\ndirect\n0.167720 0.335440 0.250001 Au\n0.167720 0.832279 0.250001 Au\n0.664558 0.832279 0.250001 Au\n0.335442 0.167721 0.750000 Au\n0.832280 0.167721 0.750000 Au\n0.832279 0.664558 0.750000 Au\n0.666667 0.333333 0.250001 Pt\n0.333334 0.666669 0.750000 Pt\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Au",
"Pt"
],
"chemical_system": "Au-Pt",
"density": 19.940079331259568,
"density_atomic": 0.06111168130863533,
"volume": 130.90786947256788,
"volume_molar": 9.854320206943886,
"formula_full": "Pt2 Au6",
"formula_reduced": "PtAu3",
"formula_anonymous": "AB3",
"formation_energy": 0.09743189875,
"spacegroup": 194
},
{
"id": "oqmd-1486200",
"created_at": "2022-09-04T15:52:59.711852Z",
"updated_at": "2022-09-04T15:52:59.711879Z",
"structure_string": "Re11 W2\n1.0\n2.537626 1.465099 9.020321\n-2.537626 1.465099 9.020321\n0.000000 -2.930198 9.020321\nRe W\n11 2\ndirect\n0.000000 0.000000 0.000000 Re\n0.582369 0.089750 0.089750 Re\n0.089750 0.582369 0.089750 Re\n0.165031 0.165031 0.165031 Re\n0.910250 0.910250 0.417631 Re\n0.454013 0.454013 0.454013 Re\n0.545987 0.545987 0.545987 Re\n0.089750 0.089750 0.582369 Re\n0.834969 0.834969 0.834969 Re\n0.910250 0.417631 0.910250 Re\n0.417631 0.910250 0.910250 Re\n0.349049 0.349049 0.349049 W\n0.650951 0.650951 0.650951 W\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Re",
"W"
],
"chemical_system": "Re-W",
"density": 19.937489300905757,
"density_atomic": 0.06460639701629751,
"volume": 201.2184644303975,
"volume_molar": 9.321276279314668,
"formula_full": "Re11 W2",
"formula_reduced": "Re11W2",
"formula_anonymous": "A2B11",
"formation_energy": 0.159678420384615,
"spacegroup": 166
},
{
"id": "oqmd-1516176",
"created_at": "2022-09-04T15:55:19.288864Z",
"updated_at": "2022-09-04T15:55:19.288885Z",
"structure_string": "Ta4 Re26\n1.0\n9.644060 0.000000 0.000000\n0.000000 9.644060 0.000000\n0.000000 0.000000 4.983584\nRe Ta\n26 4\ndirect\n0.369398 0.035162 0.000000 Re\n0.563828 0.236042 0.000000 Re\n0.035162 0.369398 0.000000 Re\n0.763958 0.436172 0.000000 Re\n0.500000 0.500000 0.000000 Re\n0.236042 0.563828 0.000000 Re\n0.964838 0.630602 0.000000 Re\n0.436172 0.763958 0.000000 Re\n0.630602 0.964838 0.000000 Re\n0.816982 0.183018 0.247798 Re\n0.183018 0.816982 0.247798 Re\n0.316982 0.316982 0.252202 Re\n0.683018 0.683018 0.252202 Re\n0.000000 0.000000 0.500000 Re\n0.263958 0.063828 0.500000 Re\n0.535162 0.130602 0.500000 Re\n0.063828 0.263958 0.500000 Re\n0.869398 0.464838 0.500000 Re\n0.130602 0.535162 0.500000 Re\n0.936172 0.736042 0.500000 Re\n0.464838 0.869398 0.500000 Re\n0.736042 0.936172 0.500000 Re\n0.316982 0.316982 0.747798 Re\n0.683018 0.683018 0.747798 Re\n0.816982 0.183018 0.752202 Re\n0.183018 0.816982 0.752202 Re\n0.105648 0.105648 0.000000 Ta\n0.894352 0.894352 0.000000 Ta\n0.605648 0.394352 0.500000 Ta\n0.394352 0.605648 0.500000 Ta\n",
"nsites": 30,
"nelements": 2,
"elements": [
"Re",
"Ta"
],
"chemical_system": "Re-Ta",
"density": 19.93729419349846,
"density_atomic": 0.06472315280922475,
"volume": 463.5126488418564,
"volume_molar": 9.3044613845537,
"formula_full": "Ta4 Re26",
"formula_reduced": "Ta2Re13",
"formula_anonymous": "A2B13",
"formation_energy": -0.0397354276666665,
"spacegroup": 136
},
{
"id": "oqmd-1625864",
"created_at": "2022-09-04T15:59:04.076210Z",
"updated_at": "2022-09-04T15:59:04.076243Z",
"structure_string": "Re6 Ni1 Ir1\n1.0\n5.490556 0.000000 0.000000\n-2.745278 4.754961 0.000000\n0.000000 0.000000 4.364787\nIr Ni Re\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Ir\n0.333333 0.666667 0.500000 Ni\n0.500241 0.000482 0.000000 Re\n0.500241 0.499759 0.000000 Re\n0.999518 0.499759 0.000000 Re\n0.345363 0.172682 0.500000 Re\n0.827318 0.172682 0.500000 Re\n0.827318 0.654637 0.500000 Re\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ir",
"Ni",
"Re"
],
"chemical_system": "Ir-Ni-Re",
"density": 19.936881810493862,
"density_atomic": 0.07020428929979952,
"volume": 113.95315129303424,
"volume_molar": 8.578023964152854,
"formula_full": "Re6 Ni1 Ir1",
"formula_reduced": "Re6NiIr",
"formula_anonymous": "ABC6",
"formation_energy": -0.158440060000002,
"spacegroup": 187
},
{
"id": "oqmd-1486173",
"created_at": "2022-09-04T15:52:59.705936Z",
"updated_at": "2022-09-04T15:52:59.705969Z",
"structure_string": "Re11 W2\n1.0\n2.532886 1.462362 9.056387\n-2.532886 1.462362 9.056387\n0.000000 -2.924725 9.056387\nRe W\n11 2\ndirect\n0.000000 0.000000 0.000000 Re\n0.583454 0.091572 0.091572 Re\n0.091572 0.583454 0.091572 Re\n0.348517 0.348517 0.348517 Re\n0.908428 0.908428 0.416546 Re\n0.454647 0.454647 0.454647 Re\n0.545353 0.545353 0.545353 Re\n0.091572 0.091572 0.583454 Re\n0.651483 0.651483 0.651483 Re\n0.908428 0.416546 0.908428 Re\n0.416546 0.908428 0.908428 Re\n0.166162 0.166162 0.166162 W\n0.833838 0.833838 0.833838 W\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Re",
"W"
],
"chemical_system": "Re-W",
"density": 19.932484681034737,
"density_atomic": 0.06459017980592448,
"volume": 201.26898607592335,
"volume_molar": 9.323616652089926,
"formula_full": "Re11 W2",
"formula_reduced": "Re11W2",
"formula_anonymous": "A2B11",
"formation_energy": 0.1545742157692302,
"spacegroup": 166
},
{
"id": "oqmd-1577004",
"created_at": "2022-09-04T15:56:08.965283Z",
"updated_at": "2022-09-04T15:56:08.965315Z",
"structure_string": "V1 Re28\n1.0\n-4.786448 4.786448 4.786448\n4.786448 -4.786448 4.786448\n4.786448 4.786448 -4.786448\nRe V\n28 1\ndirect\n0.645054 0.000000 0.000000 Re\n0.373797 0.193436 0.000000 Re\n0.193436 0.373797 0.000000 Re\n0.684369 0.400536 0.000000 Re\n0.000000 0.645054 0.000000 Re\n0.400536 0.684369 0.000000 Re\n0.806564 0.806564 0.180361 Re\n0.373797 0.000000 0.193436 Re\n0.000000 0.373797 0.193436 Re\n0.599464 0.599464 0.283833 Re\n0.716167 0.315631 0.315631 Re\n0.315631 0.716167 0.315631 Re\n0.354946 0.354946 0.354946 Re\n0.193436 0.000000 0.373797 Re\n0.000000 0.193436 0.373797 Re\n0.684369 0.000000 0.400536 Re\n0.000000 0.684369 0.400536 Re\n0.599464 0.283833 0.599464 Re\n0.283833 0.599464 0.599464 Re\n0.819639 0.626203 0.626203 Re\n0.626203 0.819639 0.626203 Re\n0.000000 0.000000 0.645054 Re\n0.400536 0.000000 0.684369 Re\n0.000000 0.400536 0.684369 Re\n0.315631 0.315631 0.716167 Re\n0.806564 0.180361 0.806564 Re\n0.180361 0.806564 0.806564 Re\n0.626203 0.626203 0.819639 Re\n0.000000 0.000000 0.000000 V\n",
"nsites": 29,
"nelements": 2,
"elements": [
"Re",
"V"
],
"chemical_system": "Re-V",
"density": 19.930848729683824,
"density_atomic": 0.06611469081182395,
"volume": 438.6317117104878,
"volume_molar": 9.10862727489758,
"formula_full": "V1 Re28",
"formula_reduced": "VRe28",
"formula_anonymous": "AB28",
"formation_energy": 0.0311148758620682,
"spacegroup": 217
},
{
"id": "oqmd-313200",
"created_at": "2022-09-04T14:50:36.134315Z",
"updated_at": "2022-09-04T14:50:36.134336Z",
"structure_string": "Np3 N1\n1.0\n0.000000 3.114269 3.114269\n3.114269 0.000000 3.114269\n3.114269 3.114269 0.000000\nN Np\n1 3\ndirect\n0.749999 0.749999 0.749999 N\n0.000000 0.000000 0.000000 Np\n0.249999 0.249999 0.249999 Np\n0.500000 0.500000 0.500000 Np\n",
"nsites": 4,
"nelements": 2,
"elements": [
"N",
"Np"
],
"chemical_system": "N-Np",
"density": 19.929332529885723,
"density_atomic": 0.06621579954463545,
"volume": 60.40854339157586,
"volume_molar": 9.094718785265941,
"formula_full": "Np3 N1",
"formula_reduced": "Np3N",
"formula_anonymous": "AB3",
"formation_energy": 0.492212102101622,
"spacegroup": 225
},
{
"id": "oqmd-539341",
"created_at": "2022-09-04T15:12:37.474950Z",
"updated_at": "2022-09-04T15:12:37.474963Z",
"structure_string": "Re1 Ir1 W2\n1.0\n0.000000 3.144342 3.144342\n3.144342 0.000000 3.144342\n3.144342 3.144342 0.000000\nIr Re W\n1 1 2\ndirect\n0.249998 0.249998 0.249998 Ir\n0.750000 0.750000 0.750000 Re\n0.000000 0.000000 0.000000 W\n0.500000 0.500000 0.500000 W\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ir",
"Re",
"W"
],
"chemical_system": "Ir-Re-W",
"density": 19.92641357298735,
"density_atomic": 0.06433401639448316,
"volume": 62.1755056527609,
"volume_molar": 9.360741171627547,
"formula_full": "Re1 Ir1 W2",
"formula_reduced": "ReIrW2",
"formula_anonymous": "ABC2",
"formation_energy": 0.28408207375,
"spacegroup": 225
},
{
"id": "oqmd-876109",
"created_at": "2022-09-04T15:35:53.399603Z",
"updated_at": "2022-09-04T15:35:53.399620Z",
"structure_string": "Pu1 U1 Re1\n1.0\n0.000000 3.030999 3.030999\n3.030999 0.000000 3.030999\n3.030999 3.030999 0.000000\nPu Re U\n1 1 1\ndirect\n0.250000 0.250000 0.250000 Pu\n0.750000 0.750000 0.750000 Re\n0.000000 0.000000 0.000000 U\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Pu",
"Re",
"U"
],
"chemical_system": "Pu-Re-U",
"density": 19.924688151295516,
"density_atomic": 0.053868375625460554,
"volume": 55.69130246025218,
"volume_molar": 11.179362084112432,
"formula_full": "Pu1 U1 Re1",
"formula_reduced": "PuURe",
"formula_anonymous": "ABC",
"formation_energy": 0.526348973333332,
"spacegroup": 216
},
{
"id": "oqmd-324353",
"created_at": "2022-09-04T14:50:59.691715Z",
"updated_at": "2022-09-04T14:50:59.691741Z",
"structure_string": "Re6 Hg2\n1.0\n5.675963 0.000000 0.000000\n-2.837981 4.915528 0.000000\n0.000000 0.000000 4.535893\nHg Re\n2 6\ndirect\n0.666666 0.333333 0.249999 Hg\n0.333333 0.666667 0.750000 Hg\n0.159550 0.319101 0.249999 Re\n0.159550 0.840449 0.249999 Re\n0.680899 0.840449 0.249999 Re\n0.319102 0.159549 0.750000 Re\n0.840449 0.159549 0.750000 Re\n0.840450 0.680901 0.750000 Re\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Hg",
"Re"
],
"chemical_system": "Hg-Re",
"density": 19.923656877491094,
"density_atomic": 0.0632146089620182,
"volume": 126.55302518452199,
"volume_molar": 9.526501640812704,
"formula_full": "Re6 Hg2",
"formula_reduced": "Re3Hg",
"formula_anonymous": "AB3",
"formation_energy": 0.695274347508432,
"spacegroup": 194
}
]
}