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=29",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=formula_anonymous&page=27",
"results": [
{
"id": "oqmd-100324",
"created_at": "2022-09-04T15:16:20.807658Z",
"updated_at": "2022-09-04T15:16:20.807684Z",
"structure_string": "K8\n1.0\n0.000000 0.000000 -8.490439\n-6.008258 6.008258 4.245219\n6.008258 6.008258 -4.245219\nK\n8\ndirect\n0.002745 0.250911 0.245422 K\n0.251833 0.749088 0.245423 K\n0.497257 0.245422 0.250911 K\n0.751834 0.754578 0.250913 K\n0.502746 0.754577 0.749087 K\n0.248169 0.245423 0.749088 K\n0.997256 0.749087 0.754577 K\n0.748168 0.250913 0.754578 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8473048074302688,
"density_atomic": 0.013050666700938707,
"volume": 612.9955030898595,
"volume_molar": 46.14431506067687,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"formation_energy": 0.1053905225,
"spacegroup": 140
},
{
"id": "oqmd-88553",
"created_at": "2022-09-04T15:15:51.785429Z",
"updated_at": "2022-09-04T15:15:51.785447Z",
"structure_string": "Gd2\n1.0\n3.620878 0.000000 0.000000\n-1.810439 3.135694 0.000000\n0.000000 0.000000 5.728707\nGd\n2\ndirect\n0.333303 0.666605 0.250001 Gd\n0.666697 0.333394 0.750000 Gd\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Gd"
],
"chemical_system": "Gd",
"density": 8.02907601596777,
"density_atomic": 0.030748633359368782,
"volume": 65.04354117548516,
"volume_molar": 19.58506802438137,
"formula_full": "Gd2",
"formula_reduced": "Gd",
"formula_anonymous": "A",
"formation_energy": 0.0171621174999999,
"spacegroup": 194
},
{
"id": "oqmd-11536",
"created_at": "2022-09-04T15:15:46.679623Z",
"updated_at": "2022-09-04T15:15:46.679662Z",
"structure_string": "S104\n1.0\n13.365516 0.000000 -0.031602\n0.000000 12.868393 0.000000\n-6.378931 0.000000 16.885752\nS\n104\ndirect\n0.659947 0.010586 0.001107 S\n0.236485 0.397561 0.009798 S\n0.823216 0.050125 0.032041 S\n0.471431 0.289717 0.033955 S\n0.397864 0.428412 0.044255 S\n0.900998 0.910321 0.045368 S\n0.089860 0.126156 0.063659 S\n0.540789 0.724575 0.081634 S\n0.140510 0.715854 0.083440 S\n0.612674 0.057738 0.088590 S\n0.048100 0.595448 0.101082 S\n0.203320 0.359182 0.109841 S\n0.762814 0.332313 0.113031 S\n0.292728 0.659526 0.115425 S\n0.922194 0.344908 0.124302 S\n0.228894 0.201629 0.129638 S\n0.686677 0.806139 0.137017 S\n0.719480 0.470813 0.149019 S\n0.657452 0.939326 0.181693 S\n0.071810 0.592103 0.220508 S\n0.410051 0.951647 0.224575 S\n0.264588 0.946042 0.231525 S\n0.361523 0.696580 0.237487 S\n0.947580 0.668575 0.239288 S\n0.014747 0.324583 0.242029 S\n0.518898 0.296720 0.246128 S\n0.481102 0.796720 0.253872 S\n0.985253 0.824583 0.257972 S\n0.052420 0.168575 0.260712 S\n0.638477 0.196579 0.262513 S\n0.735412 0.446042 0.268475 S\n0.589949 0.451648 0.275425 S\n0.928191 0.092102 0.279492 S\n0.342548 0.439325 0.318307 S\n0.280521 0.970814 0.350981 S\n0.313323 0.306138 0.362982 S\n0.771106 0.701628 0.370362 S\n0.077805 0.844908 0.375698 S\n0.707272 0.159526 0.384575 S\n0.237186 0.832313 0.386969 S\n0.796680 0.859182 0.390159 S\n0.951901 0.095449 0.398918 S\n0.387327 0.557737 0.411411 S\n0.859489 0.215854 0.416560 S\n0.459210 0.224576 0.418366 S\n0.910140 0.626156 0.436341 S\n0.099001 0.410321 0.454632 S\n0.602136 0.928413 0.455745 S\n0.528569 0.789717 0.466044 S\n0.176784 0.550125 0.467959 S\n0.763515 0.897561 0.490202 S\n0.340052 0.510585 0.498893 S\n0.659947 0.489415 0.501107 S\n0.236485 0.102439 0.509798 S\n0.823216 0.449875 0.532041 S\n0.471431 0.210283 0.533955 S\n0.397864 0.071588 0.544255 S\n0.900999 0.589679 0.545368 S\n0.089860 0.373844 0.563659 S\n0.540790 0.775425 0.581634 S\n0.140511 0.784146 0.583440 S\n0.612674 0.442263 0.588590 S\n0.048099 0.904552 0.601082 S\n0.203320 0.140818 0.609840 S\n0.762814 0.167687 0.613030 S\n0.292729 0.840474 0.615425 S\n0.922195 0.155092 0.624302 S\n0.228894 0.298371 0.629638 S\n0.686677 0.693861 0.637017 S\n0.719479 0.029187 0.649020 S\n0.657453 0.560675 0.681694 S\n0.071809 0.907897 0.720508 S\n0.410051 0.548353 0.724575 S\n0.264586 0.553958 0.731525 S\n0.361523 0.803420 0.737487 S\n0.947581 0.831425 0.739288 S\n0.014747 0.175417 0.742028 S\n0.518898 0.203280 0.746128 S\n0.481102 0.703280 0.753872 S\n0.985253 0.675417 0.757972 S\n0.052420 0.331425 0.760713 S\n0.638477 0.303421 0.762514 S\n0.735413 0.053959 0.768476 S\n0.589950 0.048353 0.775425 S\n0.928191 0.407898 0.779492 S\n0.342548 0.060675 0.818306 S\n0.280520 0.529187 0.850980 S\n0.313323 0.193861 0.862983 S\n0.771106 0.798371 0.870362 S\n0.077806 0.655092 0.875699 S\n0.707272 0.340474 0.884575 S\n0.237186 0.667687 0.886969 S\n0.796680 0.640818 0.890159 S\n0.951901 0.404552 0.898918 S\n0.387326 0.942263 0.911410 S\n0.859490 0.284146 0.916560 S\n0.459210 0.275424 0.918366 S\n0.910140 0.873844 0.936341 S\n0.099001 0.089679 0.954632 S\n0.602136 0.571587 0.955745 S\n0.528569 0.710283 0.966044 S\n0.176784 0.949875 0.967959 S\n0.763516 0.602439 0.990202 S\n0.340054 0.989415 0.998893 S\n",
"nsites": 104,
"nelements": 1,
"elements": [
"S"
],
"chemical_system": "S",
"density": 1.90840840485411,
"density_atomic": 0.03584189629056651,
"volume": 2901.6321892369438,
"volume_molar": 16.80195911281907,
"formula_full": "S104",
"formula_reduced": "S",
"formula_anonymous": "A",
"formation_energy": 0.0266922128846101,
"spacegroup": 14
},
{
"id": "oqmd-632557",
"created_at": "2022-09-04T15:15:51.349484Z",
"updated_at": "2022-09-04T15:15:51.349503Z",
"structure_string": "Br1\n1.0\n-2.858200 0.000000 0.000000\n0.000000 -2.858200 0.000000\n1.429100 1.429100 3.527445\nBr\n1\ndirect\n0.000000 0.000000 0.000000 Br\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Br"
],
"chemical_system": "Br",
"density": 4.604390375114687,
"density_atomic": 0.03470200110446555,
"volume": 28.816781977201803,
"volume_molar": 17.353871731694035,
"formula_full": "Br1",
"formula_reduced": "Br",
"formula_anonymous": "A",
"formation_energy": 0.1736173425,
"spacegroup": 139
},
{
"id": "oqmd-598515",
"created_at": "2022-09-04T15:15:51.130849Z",
"updated_at": "2022-09-04T15:15:51.130866Z",
"structure_string": "Cd2\n1.0\n2.988186 0.000000 0.000000\n-1.494093 2.587855 0.000000\n0.000000 0.000000 5.635583\nCd\n2\ndirect\n0.333301 0.666602 0.250001 Cd\n0.666699 0.333400 0.750000 Cd\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Cd"
],
"chemical_system": "Cd",
"density": 8.56646191809034,
"density_atomic": 0.04589269689242821,
"volume": 43.57991871098728,
"volume_molar": 13.122220239346158,
"formula_full": "Cd2",
"formula_reduced": "Cd",
"formula_anonymous": "A",
"formation_energy": 0.0012516799999999,
"spacegroup": 194
},
{
"id": "oqmd-122927",
"created_at": "2022-09-04T15:15:51.909958Z",
"updated_at": "2022-09-04T15:15:51.909975Z",
"structure_string": "Zn2\n1.0\n2.628484 0.000000 0.000000\n-1.314242 2.276289 0.000000\n0.000000 0.000000 5.008547\nZn\n2\ndirect\n0.333306 0.666611 0.250001 Zn\n0.666694 0.333389 0.750000 Zn\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Zn"
],
"chemical_system": "Zn",
"density": 7.248900050877741,
"density_atomic": 0.06673989279249455,
"volume": 29.967084397608087,
"volume_molar": 9.023300020459784,
"formula_full": "Zn2",
"formula_reduced": "Zn",
"formula_anonymous": "A",
"formation_energy": 0.0019151399999999,
"spacegroup": 194
},
{
"id": "oqmd-17557",
"created_at": "2022-09-04T14:48:54.883414Z",
"updated_at": "2022-09-04T14:48:54.883444Z",
"structure_string": "La1\n1.0\n2.634196 -2.634196 0.000000\n-2.634196 0.000000 -2.634196\n2.634196 2.634196 0.000000\nLa\n1\ndirect\n0.000000 0.000000 0.000000 La\n",
"nsites": 1,
"nelements": 1,
"elements": [
"La"
],
"chemical_system": "La",
"density": 6.309489068480744,
"density_atomic": 0.027354308874375604,
"volume": 36.557311851397536,
"volume_molar": 22.015327777633217,
"formula_full": "La1",
"formula_reduced": "La",
"formula_anonymous": "A",
"formation_energy": 0.0128822500000005,
"spacegroup": 225
},
{
"id": "oqmd-88555",
"created_at": "2022-09-04T15:15:51.951590Z",
"updated_at": "2022-09-04T15:15:51.951617Z",
"structure_string": "Tm2\n1.0\n3.533774 0.000000 0.000000\n-1.766887 3.060243 0.000000\n0.000000 0.000000 5.503487\nTm\n2\ndirect\n0.333305 0.666610 0.250000 Tm\n0.666695 0.333389 0.750001 Tm\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Tm"
],
"chemical_system": "Tm",
"density": 9.42679513774572,
"density_atomic": 0.033604494468471864,
"volume": 59.51584844927287,
"volume_molar": 17.920640840617448,
"formula_full": "Tm2",
"formula_reduced": "Tm",
"formula_anonymous": "A",
"formation_energy": 0.0009186950000001,
"spacegroup": 194
},
{
"id": "oqmd-122925",
"created_at": "2022-09-04T15:15:51.932330Z",
"updated_at": "2022-09-04T15:15:51.932357Z",
"structure_string": "Zn2\n1.0\n2.627443 0.000000 0.000000\n-1.313721 2.275372 0.000000\n0.000000 0.000000 4.993641\nZn\n2\ndirect\n0.333306 0.666612 0.250000 Zn\n0.666693 0.333387 0.750000 Zn\n",
"nsites": 2,
"nelements": 1,
"elements": [
"Zn"
],
"chemical_system": "Zn",
"density": 7.276349865472241,
"density_atomic": 0.06699262047122548,
"volume": 29.854034458303293,
"volume_molar": 8.98925988808964,
"formula_full": "Zn2",
"formula_reduced": "Zn",
"formula_anonymous": "A",
"formation_energy": 0.0025135999999998,
"spacegroup": 194
},
{
"id": "oqmd-9275",
"created_at": "2022-09-04T14:49:12.293172Z",
"updated_at": "2022-09-04T14:49:12.293209Z",
"structure_string": "Sc1\n1.0\n1.614352 1.614352 2.285732\n1.614352 -1.614352 -2.285732\n-1.614352 1.614352 -2.285732\nSc\n1\ndirect\n0.000000 0.000000 0.000000 Sc\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Sc"
],
"chemical_system": "Sc",
"density": 3.132954863113661,
"density_atomic": 0.04196799563740819,
"volume": 23.827680707930917,
"volume_molar": 14.349364720749644,
"formula_full": "Sc1",
"formula_reduced": "Sc",
"formula_anonymous": "A",
"formation_energy": 0.0480368950000001,
"spacegroup": 225
},
{
"id": "oqmd-632555",
"created_at": "2022-09-04T15:15:51.279910Z",
"updated_at": "2022-09-04T15:15:51.279946Z",
"structure_string": "Br1\n1.0\n0.000000 -2.595332 0.000000\n-3.431441 0.000000 0.000000\n1.715722 1.297666 -3.423192\nBr\n1\ndirect\n0.000000 0.000000 0.000000 Br\n",
"nsites": 1,
"nelements": 1,
"elements": [
"Br"
],
"chemical_system": "Br",
"density": 4.352280746301703,
"density_atomic": 0.03280192141860775,
"volume": 30.48601901206689,
"volume_molar": 18.359109770270297,
"formula_full": "Br1",
"formula_reduced": "Br",
"formula_anonymous": "A",
"formation_energy": 0.1072524925,
"spacegroup": 71
},
{
"id": "oqmd-1214534",
"created_at": "2022-09-04T15:39:02.477639Z",
"updated_at": "2022-09-04T15:39:02.477675Z",
"structure_string": "I1\n1.0\n0.000000 2.580067 -2.580067\n2.580067 0.000000 2.580067\n0.000000 -2.580067 -2.580067\nI\n1\ndirect\n0.000000 0.000000 0.000000 I\n",
"nsites": 1,
"nelements": 1,
"elements": [
"I"
],
"chemical_system": "I",
"density": 6.134837582721455,
"density_atomic": 0.02911233581894641,
"volume": 34.34969994229032,
"volume_molar": 20.68587281162362,
"formula_full": "I1",
"formula_reduced": "I",
"formula_anonymous": "A",
"formation_energy": 0.470861855,
"spacegroup": 225
}
]
}