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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=73",
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"results": [
{
"id": "oqmd-1558578",
"created_at": "2022-09-04T15:55:43.704461Z",
"updated_at": "2022-09-04T15:55:43.704485Z",
"structure_string": "Tb2 Y2 Ho2 Se4 N2 O2\n1.0\n7.738862 -1.950712 0.000000\n7.738862 1.950712 0.000000\n-1.281471 0.000000 9.606298\nHo N O Se Tb Y\n2 2 2 4 2 2\ndirect\n0.393018 0.393018 0.055798 Ho\n0.606982 0.606982 0.944202 Ho\n0.903465 0.903465 0.186756 N\n0.096535 0.096535 0.813244 N\n0.536936 0.536936 0.137153 O\n0.463064 0.463064 0.862847 O\n0.213260 0.213260 0.146999 Se\n0.627676 0.627676 0.472312 Se\n0.372324 0.372324 0.527688 Se\n0.786740 0.786740 0.853001 Se\n0.803622 0.803622 0.324717 Tb\n0.196378 0.196378 0.675283 Tb\n0.046128 0.046128 0.258845 Y\n0.953872 0.953872 0.741155 Y\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"N",
"O",
"Se",
"Tb",
"Y"
],
"chemical_system": "Ho-N-O-Se-Tb-Y",
"density": 6.8781472001796145,
"density_atomic": 0.048269380739455005,
"volume": 290.03893950013975,
"volume_molar": 12.47610942536404,
"formula_full": "Tb2 Y2 Ho2 Se4 N2 O2",
"formula_reduced": "TbYHoSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.281612388460322,
"spacegroup": 12
},
{
"id": "oqmd-1557860",
"created_at": "2022-09-04T15:55:40.899180Z",
"updated_at": "2022-09-04T15:55:40.899205Z",
"structure_string": "Tb2 Sm2 Dy2 Se4 N2 O2\n1.0\n7.792472 -1.966351 0.000000\n7.792472 1.966351 0.000000\n-1.349093 0.000000 9.718385\nDy N O Se Sm Tb\n2 2 2 4 2 2\ndirect\n0.606729 0.606729 0.444500 Dy\n0.393271 0.393271 0.555500 Dy\n0.094743 0.094743 0.314493 N\n0.905257 0.905257 0.685507 N\n0.462513 0.462513 0.363643 O\n0.537487 0.537487 0.636357 O\n0.373661 0.373661 0.032006 Se\n0.786414 0.786414 0.354456 Se\n0.213586 0.213586 0.645544 Se\n0.626339 0.626339 0.967994 Se\n0.194893 0.194893 0.173649 Sm\n0.805107 0.805107 0.826351 Sm\n0.952433 0.952433 0.244260 Tb\n0.047567 0.047567 0.755740 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Dy",
"N",
"O",
"Se",
"Sm",
"Tb"
],
"chemical_system": "Dy-N-O-Se-Sm-Tb",
"density": 7.356525174866673,
"density_atomic": 0.04700755320525115,
"volume": 297.8244780976194,
"volume_molar": 12.81100663483858,
"formula_full": "Tb2 Sm2 Dy2 Se4 N2 O2",
"formula_reduced": "TbSmDySe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.265637996436515,
"spacegroup": 12
},
{
"id": "oqmd-1558066",
"created_at": "2022-09-04T15:55:41.098013Z",
"updated_at": "2022-09-04T15:55:41.098039Z",
"structure_string": "Tb2 Nd2 Sm2 Se4 N2 O2\n1.0\n7.904237 -1.988292 0.000000\n7.904237 1.988292 0.000000\n-1.506924 0.000000 9.888619\nN Nd O Se Sm Tb\n2 2 2 4 2 2\ndirect\n0.905337 0.905337 0.194434 N\n0.094663 0.094663 0.805566 N\n0.389499 0.389499 0.054676 Nd\n0.610501 0.610501 0.945324 Nd\n0.537559 0.537559 0.141169 O\n0.462441 0.462441 0.858831 O\n0.213805 0.213805 0.154369 Se\n0.627854 0.627854 0.465121 Se\n0.372146 0.372146 0.534879 Se\n0.786195 0.786195 0.845631 Se\n0.807089 0.807089 0.332019 Sm\n0.192911 0.192911 0.667981 Sm\n0.047143 0.047143 0.256985 Tb\n0.952857 0.952857 0.743015 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
"N",
"Nd",
"O",
"Se",
"Sm",
"Tb"
],
"chemical_system": "N-Nd-O-Se-Sm-Tb",
"density": 6.8539113015698145,
"density_atomic": 0.04504247820353986,
"volume": 310.8177115996195,
"volume_molar": 13.36991435681424,
"formula_full": "Tb2 Nd2 Sm2 Se4 N2 O2",
"formula_reduced": "TbNdSmSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.226936016912705,
"spacegroup": 12
},
{
"id": "oqmd-1557877",
"created_at": "2022-09-04T15:55:40.927473Z",
"updated_at": "2022-09-04T15:55:40.927510Z",
"structure_string": "Tb2 Nd2 Ho2 S4 N2 O2\n1.0\n7.611752 -1.935958 0.000000\n7.611752 1.935958 0.000000\n-1.688288 0.000000 9.557242\nHo N Nd O S Tb\n2 2 2 2 4 2\ndirect\n0.609624 0.609624 0.446766 Ho\n0.390376 0.390376 0.553234 Ho\n0.093535 0.093535 0.313773 N\n0.906465 0.906465 0.686227 N\n0.195334 0.195334 0.171311 Nd\n0.804666 0.804666 0.828689 Nd\n0.459536 0.459536 0.364306 O\n0.540464 0.540464 0.635694 O\n0.370422 0.370422 0.035754 S\n0.785239 0.785239 0.355103 S\n0.214761 0.214761 0.644897 S\n0.629578 0.629578 0.964246 S\n0.946150 0.946150 0.242753 Tb\n0.053850 0.053850 0.757247 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Ho",
"N",
"Nd",
"O",
"S",
"Tb"
],
"chemical_system": "Ho-N-Nd-O-S-Tb",
"density": 6.629074209954275,
"density_atomic": 0.049703262417407724,
"volume": 281.6716512978178,
"volume_molar": 12.116188087264966,
"formula_full": "Tb2 Nd2 Ho2 S4 N2 O2",
"formula_reduced": "TbNdHoS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.425350978892709,
"spacegroup": 12
},
{
"id": "oqmd-1557997",
"created_at": "2022-09-04T15:55:40.823612Z",
"updated_at": "2022-09-04T15:55:40.823638Z",
"structure_string": "Tb4 Ho2 Se2 S2 N2 O2\n1.0\n7.728100 -1.924411 0.000000\n7.728100 1.924411 0.000000\n-1.462032 0.000000 9.432994\nHo N O S Se Tb\n2 2 2 2 2 4\ndirect\n0.193864 0.193864 0.166164 Ho\n0.806136 0.806136 0.833836 Ho\n0.094697 0.094697 0.301261 N\n0.905303 0.905303 0.698739 N\n0.461833 0.461833 0.358891 O\n0.538167 0.538167 0.641109 O\n0.365441 0.365441 0.028297 S\n0.634559 0.634559 0.971703 S\n0.785438 0.785438 0.347577 Se\n0.214562 0.214562 0.652423 Se\n0.949981 0.949981 0.231905 Tb\n0.607806 0.607806 0.441598 Tb\n0.392194 0.392194 0.558402 Tb\n0.050019 0.050019 0.768095 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Ho",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-O-S-Se-Tb",
"density": 7.383848610166145,
"density_atomic": 0.04989740017783289,
"volume": 280.5757404214329,
"volume_molar": 12.069047161850646,
"formula_full": "Tb4 Ho2 Se2 S2 N2 O2",
"formula_reduced": "Tb2HoSeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.272169088271756,
"spacegroup": 12
},
{
"id": "oqmd-1558024",
"created_at": "2022-09-04T15:55:40.936177Z",
"updated_at": "2022-09-04T15:55:40.936193Z",
"structure_string": "Tb2 Nd2 Sm2 Se4 N2 O2\n1.0\n7.886058 -2.001914 0.000000\n7.886058 2.001914 0.000000\n-1.061873 0.000000 9.762671\nN Nd O Se Sm Tb\n2 2 2 4 2 2\ndirect\n0.099573 0.099573 0.319469 N\n0.900427 0.900427 0.680531 N\n0.957351 0.957351 0.233729 Nd\n0.042649 0.042649 0.766271 Nd\n0.465772 0.465772 0.361879 O\n0.534228 0.534228 0.638121 O\n0.372652 0.372652 0.017916 Se\n0.788822 0.788822 0.354126 Se\n0.211178 0.211178 0.645874 Se\n0.627348 0.627348 0.982084 Se\n0.200672 0.200672 0.179156 Sm\n0.799328 0.799328 0.820844 Sm\n0.607027 0.607027 0.446881 Tb\n0.392973 0.392973 0.553119 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
"N",
"Nd",
"O",
"Se",
"Sm",
"Tb"
],
"chemical_system": "N-Nd-O-Se-Sm-Tb",
"density": 6.9109890557467,
"density_atomic": 0.04541758132135094,
"volume": 308.25067281640025,
"volume_molar": 13.259492436179059,
"formula_full": "Tb2 Nd2 Sm2 Se4 N2 O2",
"formula_reduced": "TbNdSmSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.234569289769848,
"spacegroup": 12
},
{
"id": "oqmd-1558447",
"created_at": "2022-09-04T15:55:40.895230Z",
"updated_at": "2022-09-04T15:55:40.895246Z",
"structure_string": "Sm2 Gd2 Er2 Se4 N2 O2\n1.0\n7.810175 -1.967663 0.000000\n7.810175 1.967663 0.000000\n-1.156982 0.000000 9.627840\nEr Gd N O Se Sm\n2 2 2 2 4 2\ndirect\n0.801096 0.801096 0.322887 Er\n0.198904 0.198904 0.677113 Er\n0.390875 0.390875 0.055340 Gd\n0.609125 0.609125 0.944660 Gd\n0.900159 0.900159 0.188538 N\n0.099841 0.099841 0.811462 N\n0.535229 0.535229 0.140727 O\n0.464771 0.464771 0.859273 O\n0.213230 0.213230 0.152985 Se\n0.631707 0.631707 0.480737 Se\n0.368293 0.368293 0.519263 Se\n0.786770 0.786770 0.847015 Se\n0.043260 0.043260 0.267662 Sm\n0.956740 0.956740 0.732338 Sm\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Er",
"Gd",
"N",
"O",
"Se",
"Sm"
],
"chemical_system": "Er-Gd-N-O-Se-Sm",
"density": 7.438545740317319,
"density_atomic": 0.04731051671830235,
"volume": 295.9172922028987,
"volume_molar": 12.728968478313618,
"formula_full": "Sm2 Gd2 Er2 Se4 N2 O2",
"formula_reduced": "SmGdErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.361030657317465,
"spacegroup": 12
},
{
"id": "oqmd-1558648",
"created_at": "2022-09-04T15:55:43.708450Z",
"updated_at": "2022-09-04T15:55:43.708468Z",
"structure_string": "Nd2 Y2 Er2 Se4 N2 O2\n1.0\n7.792300 -1.962562 0.000000\n7.792300 1.962562 0.000000\n-1.521395 0.000000 9.794509\nEr N Nd O Se Y\n2 2 2 2 4 2\ndirect\n0.950836 0.950836 0.250854 Er\n0.049164 0.049164 0.749146 Er\n0.092163 0.092163 0.313455 N\n0.907837 0.907837 0.686545 N\n0.191861 0.191861 0.169832 Nd\n0.808139 0.808139 0.830168 Nd\n0.460923 0.460923 0.364109 O\n0.539077 0.539077 0.635891 O\n0.375854 0.375854 0.040948 Se\n0.786049 0.786049 0.355346 Se\n0.213951 0.213951 0.644654 Se\n0.624146 0.624146 0.959052 Se\n0.607008 0.607008 0.444730 Y\n0.392992 0.392992 0.555270 Y\n",
"nsites": 14,
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"elements": [
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"Nd",
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],
"chemical_system": "Er-N-Nd-O-Se-Y",
"density": 6.522296683787743,
"density_atomic": 0.046733286152470785,
"volume": 299.5723423840551,
"volume_molar": 12.886191525997813,
"formula_full": "Nd2 Y2 Er2 Se4 N2 O2",
"formula_reduced": "NdYErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.3370592316031806,
"spacegroup": 12
},
{
"id": "oqmd-1557896",
"created_at": "2022-09-04T15:55:40.621245Z",
"updated_at": "2022-09-04T15:55:40.621272Z",
"structure_string": "Tb2 Ho2 Tm2 S4 N2 O2\n1.0\n7.532597 -1.893572 0.000000\n7.532597 1.893572 0.000000\n-1.644642 0.000000 9.350462\nHo N O S Tb Tm\n2 2 2 4 2 2\ndirect\n0.804272 0.804272 0.331916 Ho\n0.195728 0.195728 0.668084 Ho\n0.905720 0.905720 0.198703 N\n0.094280 0.094280 0.801297 N\n0.540499 0.540499 0.140581 O\n0.459501 0.459501 0.859419 O\n0.215196 0.215196 0.155195 S\n0.633827 0.633827 0.467304 S\n0.366173 0.366173 0.532696 S\n0.784804 0.784804 0.844805 S\n0.388260 0.388260 0.056158 Tb\n0.611740 0.611740 0.943842 Tb\n0.052946 0.052946 0.262261 Tm\n0.947054 0.947054 0.737739 Tm\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"N",
"O",
"S",
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"Tm"
],
"chemical_system": "Ho-N-O-S-Tb-Tm",
"density": 7.307566994450094,
"density_atomic": 0.05248538827373358,
"volume": 266.74090562089503,
"volume_molar": 11.473937714992179,
"formula_full": "Tb2 Ho2 Tm2 S4 N2 O2",
"formula_reduced": "TbHoTmS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.4829166174641384,
"spacegroup": 12
},
{
"id": "oqmd-1557774",
"created_at": "2022-09-04T15:55:40.691359Z",
"updated_at": "2022-09-04T15:55:40.691378Z",
"structure_string": "Tb2 Dy2 Er2 S4 N2 O2\n1.0\n7.527870 -1.901768 0.000000\n7.527870 1.901768 0.000000\n-1.647063 0.000000 9.363630\nDy Er N O S Tb\n2 2 2 2 4 2\ndirect\n0.389311 0.389311 0.055702 Dy\n0.610689 0.610689 0.944298 Dy\n0.053279 0.053279 0.262217 Er\n0.946721 0.946721 0.737783 Er\n0.905675 0.905675 0.195563 N\n0.094325 0.094325 0.804437 N\n0.540481 0.540481 0.139959 O\n0.459519 0.459519 0.860041 O\n0.214438 0.214438 0.150486 S\n0.633175 0.633175 0.467096 S\n0.366825 0.366825 0.532904 S\n0.785562 0.785562 0.849514 S\n0.803488 0.803488 0.329919 Tb\n0.196512 0.196512 0.670081 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"Er",
"N",
"O",
"S",
"Tb"
],
"chemical_system": "Dy-Er-N-O-S-Tb",
"density": 7.219547678899067,
"density_atomic": 0.05221847080455114,
"volume": 268.1043658363856,
"volume_molar": 11.53258735312321,
"formula_full": "Tb2 Dy2 Er2 S4 N2 O2",
"formula_reduced": "TbDyErS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.47547598151176,
"spacegroup": 12
},
{
"id": "oqmd-1558416",
"created_at": "2022-09-04T15:55:40.715206Z",
"updated_at": "2022-09-04T15:55:40.715222Z",
"structure_string": "Tb2 Gd4 Se2 S2 N2 O2\n1.0\n7.786494 -1.940851 0.000000\n7.786494 1.940851 0.000000\n-1.457072 0.000000 9.532884\nGd N O S Se Tb\n4 2 2 2 2 2\ndirect\n0.050884 0.050884 0.265726 Gd\n0.806264 0.806264 0.333679 Gd\n0.193736 0.193736 0.666321 Gd\n0.949116 0.949116 0.734274 Gd\n0.906052 0.906052 0.196500 N\n0.093948 0.093948 0.803500 N\n0.538667 0.538667 0.139344 O\n0.461333 0.461333 0.860656 O\n0.633180 0.633180 0.469915 S\n0.366820 0.366820 0.530085 S\n0.214754 0.214754 0.149184 Se\n0.785246 0.785246 0.850816 Se\n0.392983 0.392983 0.058682 Tb\n0.607017 0.607017 0.941318 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Gd-N-O-S-Se-Tb",
"density": 7.082421140053575,
"density_atomic": 0.04858918142891849,
"volume": 288.1299826069454,
"volume_molar": 12.393995088824123,
"formula_full": "Tb2 Gd4 Se2 S2 N2 O2",
"formula_reduced": "TbGd2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.3531039757003263,
"spacegroup": 12
},
{
"id": "oqmd-1557718",
"created_at": "2022-09-04T15:55:40.669391Z",
"updated_at": "2022-09-04T15:55:40.669422Z",
"structure_string": "Tb2 Er2 Tm2 S4 N2 O2\n1.0\n7.501680 -1.899014 0.000000\n7.501680 1.899014 0.000000\n-1.466646 0.000000 9.274415\nEr N O S Tb Tm\n2 2 2 4 2 2\ndirect\n0.801168 0.801168 0.325646 Er\n0.198832 0.198832 0.674354 Er\n0.903781 0.903781 0.191377 N\n0.096219 0.096219 0.808623 N\n0.540252 0.540252 0.137888 O\n0.459748 0.459748 0.862112 O\n0.215566 0.215566 0.149637 S\n0.636015 0.636015 0.474729 S\n0.363985 0.363985 0.525271 S\n0.784434 0.784434 0.850363 S\n0.052548 0.052548 0.266310 Tb\n0.947452 0.947452 0.733690 Tb\n0.390226 0.390226 0.056148 Tm\n0.609774 0.609774 0.943852 Tm\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"O",
"S",
"Tb",
"Tm"
],
"chemical_system": "Er-N-O-S-Tb-Tm",
"density": 7.405917963668263,
"density_atomic": 0.052981568808882794,
"volume": 264.2428360417441,
"volume_molar": 11.366482524749888,
"formula_full": "Tb2 Er2 Tm2 S4 N2 O2",
"formula_reduced": "TbErTmS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.484006349845092,
"spacegroup": 12
}
]
}