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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-elements&page=16",
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"results": [
{
"id": "oqmd-1557738",
"created_at": "2022-09-04T15:55:38.175005Z",
"updated_at": "2022-09-04T15:55:38.175019Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.706814 -1.911863 0.000000\n7.706814 1.911863 0.000000\n-1.556692 0.000000 9.421802\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.948135 0.948135 0.235070 Er\n0.051865 0.051865 0.764930 Er\n0.191644 0.191644 0.164067 Ho\n0.808356 0.808356 0.835933 Ho\n0.092266 0.092266 0.298316 N\n0.907734 0.907734 0.701684 N\n0.460242 0.460242 0.358674 O\n0.539758 0.539758 0.641326 O\n0.366087 0.366087 0.032864 S\n0.633913 0.633913 0.967136 S\n0.784776 0.784776 0.347468 Se\n0.215224 0.215224 0.652532 Se\n0.607517 0.607517 0.440317 Tb\n0.392483 0.392483 0.559683 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
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"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
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"formula_anonymous": "ABCDEFG",
"formation_energy": -2.372669718319373,
"spacegroup": 12
},
{
"id": "oqmd-1557494",
"created_at": "2022-09-04T15:55:46.620241Z",
"updated_at": "2022-09-04T15:55:46.620252Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.694089 -1.917523 0.000000\n7.694089 1.917523 0.000000\n-1.433602 0.000000 9.392206\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.606217 0.606217 0.440678 Er\n0.393783 0.393783 0.559322 Er\n0.194002 0.194002 0.168039 Ho\n0.805998 0.805998 0.831961 Ho\n0.094170 0.094170 0.304145 N\n0.905830 0.905830 0.695855 N\n0.461170 0.461170 0.361457 O\n0.538830 0.538830 0.638543 O\n0.365086 0.365086 0.028574 S\n0.634914 0.634914 0.971426 S\n0.784931 0.784931 0.351664 Se\n0.215069 0.215069 0.648336 Se\n0.948824 0.948824 0.233143 Tb\n0.051176 0.051176 0.766857 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
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"density": 7.575319189665803,
"density_atomic": 0.050516429042154705,
"volume": 277.1375622832989,
"volume_molar": 11.921152928237808,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.37365433046223,
"spacegroup": 12
},
{
"id": "oqmd-1557591",
"created_at": "2022-09-04T15:55:48.994287Z",
"updated_at": "2022-09-04T15:55:48.994307Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.689865 -1.914255 0.000000\n7.689865 1.914255 0.000000\n-1.528325 0.000000 9.429820\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.394173 0.394173 0.059310 Er\n0.605827 0.605827 0.940690 Er\n0.052331 0.052331 0.262939 Ho\n0.947669 0.947669 0.737061 Ho\n0.907785 0.907785 0.195827 N\n0.092215 0.092215 0.804173 N\n0.539934 0.539934 0.138291 O\n0.460066 0.460066 0.861709 O\n0.632465 0.632465 0.466914 S\n0.367535 0.367535 0.533086 S\n0.215188 0.215188 0.147452 Se\n0.784812 0.784812 0.852548 Se\n0.808032 0.808032 0.333671 Tb\n0.191968 0.191968 0.666329 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Ho",
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"O",
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],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.562134981732564,
"density_atomic": 0.050428509432715,
"volume": 277.6207379018353,
"volume_molar": 11.94193686814228,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.373333096890802,
"spacegroup": 12
},
{
"id": "oqmd-1557608",
"created_at": "2022-09-04T15:55:49.213268Z",
"updated_at": "2022-09-04T15:55:49.213291Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.696037 -1.912713 0.000000\n7.696037 1.912713 0.000000\n-1.562579 0.000000 9.434420\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.947505 0.947505 0.237887 Er\n0.052495 0.052495 0.762113 Er\n0.606205 0.606205 0.440492 Ho\n0.393795 0.393795 0.559508 Ho\n0.091719 0.091719 0.302527 N\n0.908281 0.908281 0.697473 N\n0.460051 0.460051 0.361057 O\n0.539949 0.539949 0.638943 O\n0.367692 0.367692 0.034808 S\n0.632308 0.632308 0.965192 S\n0.784740 0.784740 0.351363 Se\n0.215260 0.215260 0.648637 Se\n0.191348 0.191348 0.165071 Tb\n0.808652 0.808652 0.834929 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Ho",
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"S",
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],
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"density": 7.558474824520008,
"density_atomic": 0.0504041014747819,
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"volume_molar": 11.947719697003206,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3732168368908018,
"spacegroup": 12
},
{
"id": "oqmd-1557465",
"created_at": "2022-09-04T15:55:48.622802Z",
"updated_at": "2022-09-04T15:55:48.622826Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.551564 -1.926466 0.000000\n7.551564 1.926466 0.000000\n-1.447194 0.000000 9.507629\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.199707 0.199707 0.179159 Er\n0.800293 0.800293 0.820841 Er\n0.951479 0.951479 0.240737 Ho\n0.048521 0.048521 0.759263 Ho\n0.097623 0.097623 0.310625 N\n0.902377 0.902377 0.689375 N\n0.461329 0.461329 0.360474 O\n0.538671 0.538671 0.639526 O\n0.785894 0.785894 0.346712 S\n0.214106 0.214106 0.653288 S\n0.369498 0.369498 0.025863 Se\n0.630502 0.630502 0.974137 Se\n0.612294 0.612294 0.446757 Tb\n0.387706 0.387706 0.553243 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Er",
"Ho",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.5891974303984036,
"density_atomic": 0.05060897684715739,
"volume": 276.6307653735219,
"volume_molar": 11.89935291161345,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.39456940903366,
"spacegroup": 12
},
{
"id": "oqmd-1557455",
"created_at": "2022-09-04T15:55:49.264301Z",
"updated_at": "2022-09-04T15:55:49.264312Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.539137 -1.927491 0.000000\n7.539137 1.927491 0.000000\n-1.494692 0.000000 9.532022\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.610390 0.610390 0.446395 Er\n0.389610 0.389610 0.553605 Er\n0.949471 0.949471 0.245238 Ho\n0.050529 0.050529 0.754762 Ho\n0.096021 0.096021 0.315328 N\n0.903979 0.903979 0.684672 N\n0.460191 0.460191 0.364197 O\n0.539809 0.539809 0.635803 O\n0.785443 0.785443 0.353597 S\n0.214557 0.214557 0.646403 S\n0.370878 0.370878 0.029191 Se\n0.629122 0.629122 0.970809 Se\n0.198789 0.198789 0.180561 Tb\n0.801211 0.801211 0.819439 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"N",
"O",
"S",
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],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.5782216490460605,
"density_atomic": 0.05053578425078149,
"volume": 277.03141857907355,
"volume_molar": 11.916587125897573,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3938582583193733,
"spacegroup": 12
},
{
"id": "oqmd-1557417",
"created_at": "2022-09-04T15:55:47.953945Z",
"updated_at": "2022-09-04T15:55:47.953970Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.540785 -1.926037 0.000000\n7.540785 1.926037 0.000000\n-1.526254 0.000000 9.536671\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.050522 0.050522 0.254599 Er\n0.949478 0.949478 0.745401 Er\n0.389235 0.389235 0.053594 Ho\n0.610765 0.610765 0.946406 Ho\n0.904270 0.904270 0.186346 N\n0.095730 0.095730 0.813654 N\n0.539764 0.539764 0.136898 O\n0.460236 0.460236 0.863102 O\n0.214398 0.214398 0.148102 S\n0.785602 0.785602 0.851898 S\n0.628589 0.628589 0.469502 Se\n0.371411 0.371411 0.530498 Se\n0.801830 0.801830 0.320894 Tb\n0.198170 0.198170 0.679106 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Ho",
"N",
"O",
"S",
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],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.578588890158266,
"density_atomic": 0.05053823321816117,
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"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.393954244033659,
"spacegroup": 12
},
{
"id": "oqmd-1557469",
"created_at": "2022-09-04T15:55:47.274812Z",
"updated_at": "2022-09-04T15:55:47.274828Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.702511 -1.916502 0.000000\n7.702511 1.916502 0.000000\n-1.436014 0.000000 9.387359\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.806060 0.806060 0.332492 Er\n0.193940 0.193940 0.667508 Er\n0.393272 0.393272 0.059491 Ho\n0.606728 0.606728 0.940509 Ho\n0.905727 0.905727 0.197591 N\n0.094273 0.094273 0.802409 N\n0.538812 0.538812 0.139463 O\n0.461188 0.461188 0.860537 O\n0.635694 0.635694 0.472086 S\n0.364306 0.364306 0.527914 S\n0.215224 0.215224 0.150131 Se\n0.784776 0.784776 0.849869 Se\n0.051033 0.051033 0.267811 Tb\n0.948967 0.948967 0.732189 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"O",
"S",
"Se",
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],
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"density": 7.5749767254822,
"density_atomic": 0.05051414530107432,
"volume": 277.1500916536789,
"volume_molar": 11.921691882752539,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.373547804747945,
"spacegroup": 12
},
{
"id": "oqmd-1557552",
"created_at": "2022-09-04T15:55:49.628032Z",
"updated_at": "2022-09-04T15:55:49.628070Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.531134 -1.929035 0.000000\n7.531134 1.929035 0.000000\n-1.304058 0.000000 9.456158\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.797911 0.797911 0.317629 Er\n0.202089 0.202089 0.682371 Er\n0.388574 0.388574 0.052713 Ho\n0.611426 0.611426 0.947287 Ho\n0.900446 0.900446 0.184426 N\n0.099554 0.099554 0.815574 N\n0.537705 0.537705 0.138661 O\n0.462295 0.462295 0.861339 O\n0.213280 0.213280 0.151202 S\n0.786720 0.786720 0.848798 S\n0.630240 0.630240 0.479312 Se\n0.369760 0.369760 0.520688 Se\n0.046660 0.046660 0.261961 Tb\n0.953340 0.953340 0.738039 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"O",
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],
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"density": 7.641016387963119,
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"volume": 274.7547429749092,
"volume_molar": 11.818655261946603,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3945431447479453,
"spacegroup": 12
},
{
"id": "oqmd-1557762",
"created_at": "2022-09-04T15:55:40.389241Z",
"updated_at": "2022-09-04T15:55:40.389265Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.553466 -1.924973 0.000000\n7.553466 1.924973 0.000000\n-1.523473 0.000000 9.522773\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.950128 0.950128 0.242719 Er\n0.049872 0.049872 0.757281 Er\n0.198237 0.198237 0.178090 Ho\n0.801763 0.801763 0.821910 Ho\n0.096412 0.096412 0.309941 N\n0.903588 0.903588 0.690059 N\n0.460483 0.460483 0.360802 O\n0.539517 0.539517 0.639198 O\n0.785452 0.785452 0.347799 S\n0.214548 0.214548 0.652201 S\n0.369923 0.369923 0.028891 Se\n0.630077 0.630077 0.971109 Se\n0.612041 0.612041 0.446406 Tb\n0.387959 0.387959 0.553594 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Er",
"Ho",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.58109572925325,
"density_atomic": 0.05055495021134537,
"volume": 276.926392795817,
"volume_molar": 11.912069411253285,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3942892283193737,
"spacegroup": 12
},
{
"id": "oqmd-1557605",
"created_at": "2022-09-04T15:55:50.261020Z",
"updated_at": "2022-09-04T15:55:50.261043Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.716727 -1.913086 0.000000\n7.716727 1.913086 0.000000\n-1.514309 0.000000 9.400700\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.192648 0.192648 0.165079 Er\n0.807352 0.807352 0.834921 Er\n0.948894 0.948894 0.233051 Ho\n0.051106 0.051106 0.766949 Ho\n0.093104 0.093104 0.298309 N\n0.906896 0.906896 0.701691 N\n0.460931 0.460931 0.358125 O\n0.539069 0.539069 0.641875 O\n0.364840 0.364840 0.030438 S\n0.635160 0.635160 0.969562 S\n0.784973 0.784973 0.347295 Se\n0.215027 0.215027 0.652705 Se\n0.607702 0.607702 0.440587 Tb\n0.392298 0.392298 0.559413 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.56377341655761,
"density_atomic": 0.0504394354246775,
"volume": 277.56060079035893,
"volume_molar": 11.939350052783633,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.372675043319373,
"spacegroup": 12
},
{
"id": "oqmd-1557471",
"created_at": "2022-09-04T15:55:49.897095Z",
"updated_at": "2022-09-04T15:55:49.897123Z",
"structure_string": "Tb2 Ho2 Er2 Se2 S2 N2 O2\n1.0\n7.526724 -1.929816 0.000000\n7.526724 1.929816 0.000000\n-1.271691 0.000000 9.448401\nEr Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.611129 0.611129 0.447801 Er\n0.388871 0.388871 0.552199 Er\n0.202732 0.202732 0.182932 Ho\n0.797268 0.797268 0.817068 Ho\n0.099904 0.099904 0.317404 N\n0.900096 0.900096 0.682596 N\n0.462383 0.462383 0.362303 O\n0.537617 0.537617 0.637697 O\n0.787255 0.787255 0.350492 S\n0.212745 0.212745 0.649508 S\n0.370876 0.370876 0.020667 Se\n0.629124 0.629124 0.979333 Se\n0.953643 0.953643 0.238421 Tb\n0.046357 0.046357 0.761579 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Er",
"Ho",
"N",
"O",
"S",
"Se",
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],
"chemical_system": "Er-Ho-N-O-S-Se-Tb",
"density": 7.648673507147626,
"density_atomic": 0.05100559630774812,
"volume": 274.4796848473135,
"volume_molar": 11.806823556506863,
"formula_full": "Tb2 Ho2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbHoErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3941636433193736,
"spacegroup": 12
}
]
}