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=-volume_molar&page=22",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-volume_molar&page=20",
"results": [
{
"id": "oqmd-1222168",
"created_at": "2022-09-04T15:39:15.940790Z",
"updated_at": "2022-09-04T15:39:15.940822Z",
"structure_string": "Cs1 Yb1\n1.0\n0.000000 5.137069 5.137069\n5.137069 0.000000 5.137069\n5.137069 5.137069 0.000000\nCs Yb\n1 1\ndirect\n0.000000 0.000000 0.000000 Cs\n0.250000 0.250000 0.250000 Yb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Cs",
"Yb"
],
"chemical_system": "Cs-Yb",
"density": 1.8737726946097095,
"density_atomic": 0.0073765586989487245,
"volume": 271.1291378031102,
"volume_molar": 81.63889159938833,
"formula_full": "Cs1 Yb1",
"formula_reduced": "CsYb",
"formula_anonymous": "AB",
"formation_energy": 0.71504274,
"spacegroup": 216
},
{
"id": "oqmd-1239504",
"created_at": "2022-09-04T15:40:50.504042Z",
"updated_at": "2022-09-04T15:40:50.504063Z",
"structure_string": "Ac4 I2\n1.0\n5.235480 3.022706 8.549502\n-5.235480 3.022706 8.549502\n0.000000 -6.045411 8.549502\nAc I\n4 2\ndirect\n0.375000 0.375000 0.375000 Ac\n0.874999 0.375000 0.375000 Ac\n0.375000 0.874999 0.375000 Ac\n0.375000 0.375000 0.874999 Ac\n0.250001 0.250001 0.250001 I\n0.500000 0.500000 0.500000 I\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ac",
"I"
],
"chemical_system": "Ac-I",
"density": 2.376508531751638,
"density_atomic": 0.007391061511626052,
"volume": 811.7913767274256,
"volume_molar": 81.47869897344576,
"formula_full": "Ac4 I2",
"formula_reduced": "Ac2I",
"formula_anonymous": "AB2",
"formation_energy": 1.07914061585723,
"spacegroup": 227
},
{
"id": "oqmd-1237231",
"created_at": "2022-09-04T15:40:41.856205Z",
"updated_at": "2022-09-04T15:40:41.856221Z",
"structure_string": "Ba4 Pr2\n1.0\n0.000000 7.403540 7.403540\n7.403540 0.000000 7.403540\n7.403540 7.403540 0.000000\nBa Pr\n4 2\ndirect\n0.875000 0.875000 0.375001 Ba\n0.875000 0.375001 0.875000 Ba\n0.375001 0.875000 0.875000 Ba\n0.875000 0.875000 0.875000 Ba\n0.000000 0.000000 0.000000 Pr\n0.750000 0.750000 0.750000 Pr\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Pr"
],
"chemical_system": "Ba-Pr",
"density": 1.7004594422608748,
"density_atomic": 0.007392698138655201,
"volume": 811.6116588917636,
"volume_molar": 81.46066087172177,
"formula_full": "Ba4 Pr2",
"formula_reduced": "Ba2Pr",
"formula_anonymous": "AB2",
"formation_energy": 1.73551716916667,
"spacegroup": 227
},
{
"id": "oqmd-1239916",
"created_at": "2022-09-04T15:40:51.714105Z",
"updated_at": "2022-09-04T15:40:51.714115Z",
"structure_string": "Ba4 Hg2\n1.0\n5.232122 3.020767 8.544019\n-5.232122 3.020767 8.544019\n0.000000 -6.041534 8.544019\nBa Hg\n4 2\ndirect\n0.375000 0.375000 0.375000 Ba\n0.874999 0.375000 0.375000 Ba\n0.375000 0.874999 0.375000 Ba\n0.375000 0.375000 0.874999 Ba\n0.250000 0.250000 0.250000 Hg\n0.500000 0.500000 0.500000 Hg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ba",
"Hg"
],
"chemical_system": "Ba-Hg",
"density": 1.9479920920303833,
"density_atomic": 0.0074053008023001994,
"volume": 810.2304227988022,
"volume_molar": 81.32202756881166,
"formula_full": "Ba4 Hg2",
"formula_reduced": "Ba2Hg",
"formula_anonymous": "AB2",
"formation_energy": 0.370307695011244,
"spacegroup": 227
},
{
"id": "oqmd-1218655",
"created_at": "2022-09-04T15:39:09.557386Z",
"updated_at": "2022-09-04T15:39:09.557413Z",
"structure_string": "Rb1 Ba1\n1.0\n0.000000 5.125336 5.125336\n5.125336 0.000000 5.125336\n5.125336 5.125336 0.000000\nBa Rb\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.250000 0.250000 Rb\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Rb"
],
"chemical_system": "Ba-Rb",
"density": 1.3739063391479511,
"density_atomic": 0.007427334361721663,
"volume": 269.27561122162786,
"volume_molar": 81.08078170058393,
"formula_full": "Rb1 Ba1",
"formula_reduced": "RbBa",
"formula_anonymous": "AB",
"formation_energy": 0.80246583,
"spacegroup": 216
},
{
"id": "oqmd-1238791",
"created_at": "2022-09-04T15:40:49.290322Z",
"updated_at": "2022-09-04T15:40:49.290344Z",
"structure_string": "La2 Lu4\n1.0\n5.226702 3.017638 8.535169\n-5.226702 3.017638 8.535169\n0.000000 -6.035276 8.535169\nLa Lu\n2 4\ndirect\n0.249999 0.249999 0.249999 La\n0.500000 0.500000 0.500000 La\n0.374999 0.374999 0.374999 Lu\n0.875001 0.374999 0.374999 Lu\n0.374999 0.875001 0.374999 Lu\n0.374999 0.374999 0.875001 Lu\n",
"nsites": 6,
"nelements": 2,
"elements": [
"La",
"Lu"
],
"chemical_system": "La-Lu",
"density": 2.0099585576965837,
"density_atomic": 0.007428360905717196,
"volume": 807.7151980300438,
"volume_molar": 81.06957694213664,
"formula_full": "La2 Lu4",
"formula_reduced": "LaLu2",
"formula_anonymous": "AB2",
"formation_energy": 2.39302413,
"spacegroup": 227
},
{
"id": "oqmd-1238893",
"created_at": "2022-09-04T15:40:47.836275Z",
"updated_at": "2022-09-04T15:40:47.836302Z",
"structure_string": "Sr4 Nb2\n1.0\n5.224310 3.016257 8.531263\n-5.224310 3.016257 8.531263\n0.000000 -6.032514 8.531263\nNb Sr\n2 4\ndirect\n0.250000 0.250000 0.250000 Nb\n0.500000 0.500000 0.500000 Nb\n0.375000 0.375000 0.375000 Sr\n0.875001 0.375000 0.375000 Sr\n0.375000 0.875001 0.375000 Sr\n0.375000 0.375000 0.875001 Sr\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Nb",
"Sr"
],
"chemical_system": "Nb-Sr",
"density": 1.1040510842014277,
"density_atomic": 0.007438568856595352,
"volume": 806.6067701558135,
"volume_molar": 80.95832513078793,
"formula_full": "Sr4 Nb2",
"formula_reduced": "Sr2Nb",
"formula_anonymous": "AB2",
"formation_energy": 2.00542942,
"spacegroup": 227
},
{
"id": "oqmd-1237116",
"created_at": "2022-09-04T15:40:40.623862Z",
"updated_at": "2022-09-04T15:40:40.623879Z",
"structure_string": "Ca2 Gd4\n1.0\n5.222092 3.014976 8.527640\n-5.222092 3.014976 8.527640\n0.000000 -6.029952 8.527640\nCa Gd\n2 4\ndirect\n0.249999 0.249999 0.249999 Ca\n0.500000 0.500000 0.500000 Ca\n0.375000 0.375000 0.375000 Gd\n0.875001 0.375000 0.375000 Gd\n0.375000 0.875001 0.375000 Gd\n0.375000 0.375000 0.875001 Gd\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ca",
"Gd"
],
"chemical_system": "Ca-Gd",
"density": 1.4617812690882763,
"density_atomic": 0.007448053093386942,
"volume": 805.5796494425294,
"volume_molar": 80.85523403890613,
"formula_full": "Ca2 Gd4",
"formula_reduced": "CaGd2",
"formula_anonymous": "AB2",
"formation_energy": 2.49672997666667,
"spacegroup": 227
},
{
"id": "oqmd-1239500",
"created_at": "2022-09-04T15:40:49.247404Z",
"updated_at": "2022-09-04T15:40:49.247432Z",
"structure_string": "K4 Tc2\n1.0\n5.221948 3.014893 8.527406\n-5.221948 3.014893 8.527406\n0.000000 -6.029787 8.527406\nK Tc\n4 2\ndirect\n0.625000 0.625000 0.125001 K\n0.625000 0.125001 0.625000 K\n0.125001 0.625000 0.625000 K\n0.625000 0.625000 0.625000 K\n0.500000 0.500000 0.500000 Tc\n0.750000 0.750000 0.750000 Tc\n",
"nsites": 6,
"nelements": 2,
"elements": [
"K",
"Tc"
],
"chemical_system": "K-Tc",
"density": 0.7264469947470409,
"density_atomic": 0.007448667100087323,
"volume": 805.5132440983515,
"volume_molar": 80.84856900007519,
"formula_full": "K4 Tc2",
"formula_reduced": "K2Tc",
"formula_anonymous": "AB2",
"formation_energy": 1.93844657333333,
"spacegroup": 227
},
{
"id": "oqmd-1237901",
"created_at": "2022-09-04T15:40:43.942094Z",
"updated_at": "2022-09-04T15:40:43.942119Z",
"structure_string": "Rb4 Cu2\n1.0\n0.000000 7.384787 7.384787\n7.384787 0.000000 7.384787\n7.384787 7.384787 0.000000\nCu Rb\n2 4\ndirect\n0.500000 0.500000 0.500000 Cu\n0.750000 0.750000 0.750000 Cu\n0.625000 0.625000 0.124999 Rb\n0.625000 0.124999 0.625000 Rb\n0.124999 0.625000 0.625000 Rb\n0.625000 0.625000 0.625000 Rb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Cu",
"Rb"
],
"chemical_system": "Cu-Rb",
"density": 0.9668162605051164,
"density_atomic": 0.00744916054628257,
"volume": 805.4598854087311,
"volume_molar": 80.84321344108082,
"formula_full": "Rb4 Cu2",
"formula_reduced": "Rb2Cu",
"formula_anonymous": "AB2",
"formation_energy": 0.620579358333333,
"spacegroup": 227
},
{
"id": "oqmd-1241016",
"created_at": "2022-09-04T15:40:56.158442Z",
"updated_at": "2022-09-04T15:40:56.158464Z",
"structure_string": "Rb4 P2\n1.0\n5.220228 3.013900 8.524597\n-5.220228 3.013900 8.524597\n0.000000 -6.027801 8.524597\nP Rb\n2 4\ndirect\n0.500000 0.500000 0.500000 P\n0.750000 0.750000 0.750000 P\n0.624999 0.624999 0.125001 Rb\n0.624999 0.125001 0.624999 Rb\n0.125001 0.624999 0.624999 Rb\n0.624999 0.624999 0.624999 Rb\n",
"nsites": 6,
"nelements": 2,
"elements": [
"P",
"Rb"
],
"chemical_system": "P-Rb",
"density": 0.8332821601117484,
"density_atomic": 0.007456032369698592,
"volume": 804.7175364184408,
"volume_molar": 80.76870460587126,
"formula_full": "Rb4 P2",
"formula_reduced": "Rb2P",
"formula_anonymous": "AB2",
"formation_energy": 0.194942368680021,
"spacegroup": 227
},
{
"id": "oqmd-1239880",
"created_at": "2022-09-04T15:40:52.219345Z",
"updated_at": "2022-09-04T15:40:52.219370Z",
"structure_string": "K4 Ag2\n1.0\n5.219895 3.013708 8.524053\n-5.219895 3.013708 8.524053\n0.000000 -6.027415 8.524053\nAg K\n2 4\ndirect\n0.499999 0.499999 0.499999 Ag\n0.750000 0.750000 0.750000 Ag\n0.625000 0.625000 0.125001 K\n0.625000 0.125001 0.625000 K\n0.125001 0.625000 0.625000 K\n0.625000 0.625000 0.625000 K\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ag",
"K"
],
"chemical_system": "Ag-K",
"density": 0.7680385726029902,
"density_atomic": 0.007457460618434658,
"volume": 804.5634173606159,
"volume_molar": 80.75323582820427,
"formula_full": "K4 Ag2",
"formula_reduced": "K2Ag",
"formula_anonymous": "AB2",
"formation_energy": 0.3779759875,
"spacegroup": 227
}
]
}