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=88",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-density&page=86",
"results": [
{
"id": "oqmd-1486201",
"created_at": "2022-09-04T15:53:00.265145Z",
"updated_at": "2022-09-04T15:53:00.265173Z",
"structure_string": "Re9 W4\n1.0\n2.544653 1.469156 9.080841\n-2.544653 1.469156 9.080841\n0.000000 -2.938312 9.080841\nRe W\n9 4\ndirect\n0.000000 0.000000 0.000000 Re\n0.090395 0.583637 0.090395 Re\n0.583637 0.090395 0.090395 Re\n0.909605 0.909605 0.416363 Re\n0.454491 0.454491 0.454491 Re\n0.545509 0.545509 0.545509 Re\n0.090395 0.090395 0.583637 Re\n0.909605 0.416363 0.909605 Re\n0.416363 0.909605 0.909605 Re\n0.165899 0.165899 0.165899 W\n0.347988 0.347988 0.347988 W\n0.652012 0.652012 0.652012 W\n0.834101 0.834101 0.834101 W\n",
"nsites": 13,
"nelements": 2,
"elements": [
"Re",
"W"
],
"chemical_system": "Re-W",
"density": 19.656793334581586,
"density_atomic": 0.06382187350966079,
"volume": 203.69192073360517,
"volume_molar": 9.435857064096407,
"formula_full": "Re9 W4",
"formula_reduced": "Re9W4",
"formula_anonymous": "A4B9",
"formation_energy": 0.1199021219230758,
"spacegroup": 166
},
{
"id": "oqmd-369010",
"created_at": "2022-09-04T14:52:23.435047Z",
"updated_at": "2022-09-04T14:52:23.435073Z",
"structure_string": "Ir1 Os2 Pb1\n1.0\n0.000000 3.205815 3.205815\n3.205815 0.000000 3.205815\n3.205815 3.205815 0.000000\nIr Os Pb\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Ir\n0.000000 0.000000 0.000000 Os\n0.499999 0.499999 0.499999 Os\n0.750001 0.750001 0.750001 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ir",
"Os",
"Pb"
],
"chemical_system": "Ir-Os-Pb",
"density": 19.653044806480302,
"density_atomic": 0.06070362491937152,
"volume": 65.89392322637943,
"volume_molar": 9.920562022447257,
"formula_full": "Ir1 Os2 Pb1",
"formula_reduced": "IrOs2Pb",
"formula_anonymous": "ABC2",
"formation_energy": 0.98744982,
"spacegroup": 225
},
{
"id": "oqmd-1516600",
"created_at": "2022-09-04T15:55:22.895943Z",
"updated_at": "2022-09-04T15:55:22.895970Z",
"structure_string": "Re16 W14\n1.0\n9.660560 0.000000 0.000000\n0.000000 9.660560 0.000000\n0.000000 0.000000 5.027472\nRe W\n16 14\ndirect\n0.739391 0.067117 0.000000 Re\n0.932883 0.260609 0.000000 Re\n0.067117 0.739391 0.000000 Re\n0.260609 0.932883 0.000000 Re\n0.183521 0.183521 0.249996 Re\n0.816479 0.816479 0.249996 Re\n0.683521 0.316479 0.250004 Re\n0.316479 0.683521 0.250004 Re\n0.432883 0.239391 0.500000 Re\n0.239391 0.432883 0.500000 Re\n0.760609 0.567117 0.500000 Re\n0.567117 0.760609 0.500000 Re\n0.683521 0.316479 0.749996 Re\n0.316479 0.683521 0.749996 Re\n0.183521 0.183521 0.750004 Re\n0.816479 0.816479 0.750004 Re\n0.000000 0.000000 0.000000 W\n0.464335 0.131122 0.000000 W\n0.399493 0.399493 0.000000 W\n0.131122 0.464335 0.000000 W\n0.868878 0.535665 0.000000 W\n0.600507 0.600507 0.000000 W\n0.535665 0.868878 0.000000 W\n0.631122 0.035665 0.500000 W\n0.899493 0.100507 0.500000 W\n0.964335 0.368878 0.500000 W\n0.500000 0.500000 0.500000 W\n0.035665 0.631122 0.500000 W\n0.100507 0.899493 0.500000 W\n0.368878 0.964335 0.500000 W\n",
"nsites": 30,
"nelements": 2,
"elements": [
"Re",
"W"
],
"chemical_system": "Re-W",
"density": 19.65296755044499,
"density_atomic": 0.06393916933621194,
"volume": 469.19596096487766,
"volume_molar": 9.418547069846529,
"formula_full": "Re16 W14",
"formula_reduced": "Re8W7",
"formula_anonymous": "A7B8",
"formation_energy": 0.0602020539999993,
"spacegroup": 136
},
{
"id": "oqmd-312944",
"created_at": "2022-09-04T14:50:34.914581Z",
"updated_at": "2022-09-04T14:50:34.914601Z",
"structure_string": "Os1 W3\n1.0\n0.000000 3.152717 3.152717\n3.152717 0.000000 3.152717\n3.152717 3.152717 0.000000\nOs W\n1 3\ndirect\n0.749999 0.749999 0.749999 Os\n0.000000 0.000000 0.000000 W\n0.249999 0.249999 0.249999 W\n0.500000 0.500000 0.500000 W\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Os",
"W"
],
"chemical_system": "Os-W",
"density": 19.652675856340196,
"density_atomic": 0.06382267899342572,
"volume": 62.67364615659637,
"volume_molar": 9.435737977436409,
"formula_full": "Os1 W3",
"formula_reduced": "OsW3",
"formula_anonymous": "AB3",
"formation_energy": 0.194486027499998,
"spacegroup": 225
},
{
"id": "oqmd-1485444",
"created_at": "2022-09-04T15:52:58.190587Z",
"updated_at": "2022-09-04T15:52:58.190620Z",
"structure_string": "Re10 W2\n1.0\n5.120780 0.000000 0.000000\n-2.560390 4.434726 0.000000\n0.000000 0.000000 8.296686\nRe W\n10 2\ndirect\n0.333333 0.666667 0.069296 Re\n0.346708 0.173354 0.250000 Re\n0.826646 0.173354 0.250000 Re\n0.826646 0.653292 0.250000 Re\n0.333333 0.666667 0.430704 Re\n0.666667 0.333333 0.569296 Re\n0.173354 0.346708 0.750000 Re\n0.173354 0.826646 0.750000 Re\n0.653292 0.826646 0.750000 Re\n0.666667 0.333333 0.930704 Re\n0.000000 0.000000 0.000000 W\n0.000000 0.000000 0.500000 W\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Re",
"W"
],
"chemical_system": "Re-W",
"density": 19.65159051711269,
"density_atomic": 0.06369035683435248,
"volume": 188.41156803705638,
"volume_molar": 9.45534152942892,
"formula_full": "Re10 W2",
"formula_reduced": "Re5W",
"formula_anonymous": "AB5",
"formation_energy": 0.331820818333334,
"spacegroup": 194
},
{
"id": "oqmd-1207266",
"created_at": "2022-09-04T15:38:45.471559Z",
"updated_at": "2022-09-04T15:38:45.471587Z",
"structure_string": "Ir2 Os1 Pt2\n1.0\n-1.804652 1.804652 6.258864\n1.804652 -1.804652 6.258864\n1.804652 1.804652 -6.258864\nIr Os Pt\n2 1 2\ndirect\n0.750000 0.250000 0.500000 Ir\n0.250000 0.750000 0.500000 Ir\n0.000000 0.000000 0.000000 Os\n0.401229 0.401229 0.000000 Pt\n0.598771 0.598771 0.000000 Pt\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ir",
"Os",
"Pt"
],
"chemical_system": "Ir-Os-Pt",
"density": 19.649810029228693,
"density_atomic": 0.061323588948215116,
"volume": 81.53469302363018,
"volume_molar": 9.820267964233818,
"formula_full": "Ir2 Os1 Pt2",
"formula_reduced": "Ir2OsPt2",
"formula_anonymous": "AB2C2",
"formation_energy": 0.838924695999999,
"spacegroup": 139
},
{
"id": "oqmd-364261",
"created_at": "2022-09-04T14:51:31.735101Z",
"updated_at": "2022-09-04T14:51:31.735120Z",
"structure_string": "Pu1 Ir1 Pt2\n1.0\n0.000000 3.268516 3.268516\n3.268516 0.000000 3.268516\n3.268516 3.268516 0.000000\nIr Pt Pu\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Ir\n0.000000 0.000000 0.000000 Pt\n0.499999 0.499999 0.499999 Pt\n0.749999 0.749999 0.749999 Pu\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ir",
"Pt",
"Pu"
],
"chemical_system": "Ir-Pt-Pu",
"density": 19.649417553260694,
"density_atomic": 0.05727672133383039,
"volume": 69.83639962012643,
"volume_molar": 10.514115717100296,
"formula_full": "Pu1 Ir1 Pt2",
"formula_reduced": "PuIrPt2",
"formula_anonymous": "ABC2",
"formation_energy": 0.1034121825,
"spacegroup": 225
},
{
"id": "oqmd-298729",
"created_at": "2022-09-04T14:49:41.835587Z",
"updated_at": "2022-09-04T14:49:41.835610Z",
"structure_string": "Yb1 Ir3\n1.0\n-1.988611 1.988611 4.005665\n1.988611 -1.988611 4.005665\n1.988611 1.988611 -4.005665\nIr Yb\n3 1\ndirect\n0.499999 0.499999 0.000000 Ir\n0.749999 0.250000 0.500000 Ir\n0.250000 0.749999 0.500000 Ir\n0.000000 0.000000 0.000000 Yb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ir",
"Yb"
],
"chemical_system": "Ir-Yb",
"density": 19.64703879969445,
"density_atomic": 0.06312853333430937,
"volume": 63.3627899893892,
"volume_molar": 9.539491006560517,
"formula_full": "Yb1 Ir3",
"formula_reduced": "YbIr3",
"formula_anonymous": "AB3",
"formation_energy": -0.0693627700000006,
"spacegroup": 139
},
{
"id": "oqmd-1144691",
"created_at": "2022-09-04T15:47:37.632348Z",
"updated_at": "2022-09-04T15:47:37.632372Z",
"structure_string": "Hg1 Ir1 Pt2\n1.0\n0.000000 3.210436 3.210436\n3.210436 0.000000 3.210436\n3.210436 3.210436 0.000000\nHg Ir Pt\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Hg\n0.500001 0.500001 0.500001 Ir\n0.000000 0.000000 0.000000 Pt\n0.749999 0.749999 0.749999 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hg",
"Ir",
"Pt"
],
"chemical_system": "Hg-Ir-Pt",
"density": 19.64603652912211,
"density_atomic": 0.060441877401123154,
"volume": 66.17928118701472,
"volume_molar": 9.963523667595563,
"formula_full": "Hg1 Ir1 Pt2",
"formula_reduced": "HgIrPt2",
"formula_anonymous": "ABC2",
"formation_energy": 0.388806183758433,
"spacegroup": 216
},
{
"id": "oqmd-1214731",
"created_at": "2022-09-04T15:39:05.316430Z",
"updated_at": "2022-09-04T15:39:05.316448Z",
"structure_string": "Os4\n1.0\n-1.968985 -4.147411 0.000000\n-1.968985 4.147411 0.000000\n0.000000 0.000000 -3.938651\nOs\n4\ndirect\n0.849966 0.150031 0.000000 Os\n0.150031 0.849966 0.000000 Os\n0.650032 0.349965 0.499945 Os\n0.349965 0.650032 0.500054 Os\n",
"nsites": 4,
"nelements": 1,
"elements": [
"Os"
],
"chemical_system": "Os",
"density": 19.64224474451256,
"density_atomic": 0.06218176036098555,
"volume": 64.32754519619074,
"volume_molar": 9.684738297918061,
"formula_full": "Os4",
"formula_reduced": "Os",
"formula_anonymous": "A",
"formation_energy": 0.518119335,
"spacegroup": 139
},
{
"id": "oqmd-346524",
"created_at": "2022-09-04T14:51:08.666146Z",
"updated_at": "2022-09-04T14:51:08.666169Z",
"structure_string": "Pa1 Ir3\n1.0\n4.087505 0.000000 0.000000\n0.000000 4.087505 0.000000\n0.000000 0.000000 4.087505\nIr Pa\n3 1\ndirect\n0.499999 0.499999 0.000000 Ir\n0.499999 0.000000 0.499999 Ir\n0.000000 0.499999 0.499999 Ir\n0.000000 0.000000 0.000000 Pa\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ir",
"Pa"
],
"chemical_system": "Ir-Pa",
"density": 19.63890344909266,
"density_atomic": 0.05857133199110846,
"volume": 68.29279553702531,
"volume_molar": 10.281720690446656,
"formula_full": "Pa1 Ir3",
"formula_reduced": "PaIr3",
"formula_anonymous": "AB3",
"formation_energy": -0.8499984425,
"spacegroup": 221
},
{
"id": "oqmd-458538",
"created_at": "2022-09-04T15:02:14.269229Z",
"updated_at": "2022-09-04T15:02:14.269257Z",
"structure_string": "Tl1 Ir2 Pt1\n1.0\n0.000000 3.212200 3.212200\n3.212200 0.000000 3.212200\n3.212200 3.212200 0.000000\nIr Pt Tl\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Ir\n0.500000 0.500000 0.500000 Ir\n0.250000 0.250000 0.250000 Pt\n0.750000 0.750000 0.750000 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ir",
"Pt",
"Tl"
],
"chemical_system": "Ir-Pt-Tl",
"density": 19.636892072750957,
"density_atomic": 0.06034235595317993,
"volume": 66.28842935969601,
"volume_molar": 9.979956309085154,
"formula_full": "Tl1 Ir2 Pt1",
"formula_reduced": "TlIr2Pt",
"formula_anonymous": "ABC2",
"formation_energy": 0.53119793875,
"spacegroup": 225
}
]
}