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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=42",
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"results": [
{
"id": "oqmd-1558458",
"created_at": "2022-09-04T15:55:42.154897Z",
"updated_at": "2022-09-04T15:55:42.154932Z",
"structure_string": "Tb2 Gd2 Ho2 Se4 N2 O2\n1.0\n7.758110 -1.954942 0.000000\n7.758110 1.954942 0.000000\n-1.182012 0.000000 9.615342\nGd Ho N O Se Tb\n2 2 2 2 4 2\ndirect\n0.955384 0.955384 0.239239 Gd\n0.044616 0.044616 0.760761 Gd\n0.607317 0.607317 0.444565 Ho\n0.392683 0.392683 0.555435 Ho\n0.097693 0.097693 0.314720 N\n0.902307 0.902307 0.685280 N\n0.464199 0.464199 0.362756 O\n0.535801 0.535801 0.637244 O\n0.371656 0.371656 0.025409 Se\n0.787261 0.787261 0.351913 Se\n0.212739 0.212739 0.648087 Se\n0.628344 0.628344 0.974591 Se\n0.197749 0.197749 0.175713 Tb\n0.802251 0.802251 0.824287 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"Tb"
],
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"volume_molar": 12.546061393939222,
"formula_full": "Tb2 Gd2 Ho2 Se4 N2 O2",
"formula_reduced": "TbGdHoSe2NO",
"formula_anonymous": "ABCDEF2",
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"spacegroup": 12
},
{
"id": "oqmd-1557098",
"created_at": "2022-09-04T15:55:45.059820Z",
"updated_at": "2022-09-04T15:55:45.059845Z",
"structure_string": "Dy2 Ho2 Er2 Se4 N2 O2\n1.0\n7.701545 -1.934694 0.000000\n7.701545 1.934694 0.000000\n-1.250399 0.000000 9.531594\nDy Er Ho N O Se\n2 2 2 2 2 4\ndirect\n0.954641 0.954641 0.239288 Dy\n0.045359 0.045359 0.760712 Dy\n0.196497 0.196497 0.174944 Er\n0.803503 0.803503 0.825056 Er\n0.607890 0.607890 0.443896 Ho\n0.392110 0.392110 0.556104 Ho\n0.097135 0.097135 0.311456 N\n0.902865 0.902865 0.688544 N\n0.463372 0.463372 0.361609 O\n0.536628 0.536628 0.638391 O\n0.370475 0.370475 0.025855 Se\n0.786454 0.786454 0.349621 Se\n0.213546 0.213546 0.650379 Se\n0.629525 0.629525 0.974145 Se\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"Er",
"Ho",
"N",
"O",
"Se"
],
"chemical_system": "Dy-Er-Ho-N-O-Se",
"density": 7.981224273273988,
"density_atomic": 0.04928813242920326,
"volume": 284.04403474019614,
"volume_molar": 12.218236851741366,
"formula_full": "Dy2 Ho2 Er2 Se4 N2 O2",
"formula_reduced": "DyHoErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.389121323746037,
"spacegroup": 12
},
{
"id": "oqmd-1557299",
"created_at": "2022-09-04T15:55:48.646598Z",
"updated_at": "2022-09-04T15:55:48.646607Z",
"structure_string": "Nd2 Gd2 Y2 S4 N2 O2\n1.0\n7.641890 -1.949857 0.000000\n7.641890 1.949857 0.000000\n-1.299749 0.000000 9.464075\nGd N Nd O S Y\n2 2 2 2 4 2\ndirect\n0.387142 0.387142 0.052985 Gd\n0.612858 0.612858 0.947015 Gd\n0.898394 0.898394 0.189860 N\n0.101606 0.101606 0.810140 N\n0.047180 0.047180 0.274180 Nd\n0.952820 0.952820 0.725820 Nd\n0.536473 0.536473 0.140575 O\n0.463527 0.463527 0.859425 O\n0.212701 0.212701 0.153354 S\n0.635870 0.635870 0.482818 S\n0.364130 0.364130 0.517182 S\n0.787299 0.787299 0.846646 S\n0.796309 0.796309 0.325161 Y\n0.203691 0.203691 0.674839 Y\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"N",
"Nd",
"O",
"S",
"Y"
],
"chemical_system": "Gd-N-Nd-O-S-Y",
"density": 5.705472185992462,
"density_atomic": 0.049638234086031977,
"volume": 282.0406538986759,
"volume_molar": 12.13206084157335,
"formula_full": "Nd2 Gd2 Y2 S4 N2 O2",
"formula_reduced": "NdGdYS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.5130334616784253,
"spacegroup": 12
},
{
"id": "oqmd-1558281",
"created_at": "2022-09-04T15:55:42.286266Z",
"updated_at": "2022-09-04T15:55:42.286293Z",
"structure_string": "Dy2 Ho4 Se2 S2 N2 O2\n1.0\n7.689626 -1.914010 0.000000\n7.689626 1.914010 0.000000\n-1.469998 0.000000 9.388214\nDy Ho N O S Se\n2 4 2 2 2 2\ndirect\n0.949308 0.949308 0.233562 Dy\n0.050692 0.050692 0.766438 Dy\n0.193465 0.193465 0.166775 Ho\n0.606703 0.606703 0.440966 Ho\n0.393297 0.393297 0.559034 Ho\n0.806535 0.806535 0.833225 Ho\n0.093972 0.093972 0.302669 N\n0.906028 0.906028 0.697331 N\n0.461449 0.461449 0.360305 O\n0.538551 0.538551 0.639695 O\n0.365926 0.365926 0.029606 S\n0.634074 0.634074 0.970394 S\n0.785229 0.785229 0.349730 Se\n0.214771 0.214771 0.650270 Se\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"Ho",
"N",
"O",
"S",
"Se"
],
"chemical_system": "Dy-Ho-N-O-S-Se",
"density": 7.611830210238561,
"density_atomic": 0.0506600529526683,
"volume": 276.35186274045554,
"volume_molar": 11.887355833651592,
"formula_full": "Dy2 Ho4 Se2 S2 N2 O2",
"formula_reduced": "DyHo2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.46888872693842,
"spacegroup": 12
},
{
"id": "oqmd-1557975",
"created_at": "2022-09-04T15:55:42.072584Z",
"updated_at": "2022-09-04T15:55:42.072610Z",
"structure_string": "Tb2 Dy4 Se2 S2 N2 O2\n1.0\n7.727500 -1.923939 0.000000\n7.727500 1.923939 0.000000\n-1.522939 0.000000 9.460318\nDy N O S Se Tb\n4 2 2 2 2 2\ndirect\n0.051874 0.051874 0.265197 Dy\n0.807966 0.807966 0.334837 Dy\n0.192034 0.192034 0.665163 Dy\n0.948126 0.948126 0.734803 Dy\n0.907325 0.907325 0.199392 N\n0.092675 0.092675 0.800608 N\n0.539529 0.539529 0.140114 O\n0.460471 0.460471 0.859886 O\n0.633559 0.633559 0.468757 S\n0.366441 0.366441 0.531243 S\n0.215456 0.215456 0.151419 Se\n0.784544 0.784544 0.848581 Se\n0.392654 0.392654 0.059249 Tb\n0.607346 0.607346 0.940751 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-N-O-S-Se-Tb",
"density": 7.37841035362147,
"density_atomic": 0.04976935276839478,
"volume": 281.2976103014639,
"volume_molar": 12.100098604907442,
"formula_full": "Tb2 Dy4 Se2 S2 N2 O2",
"formula_reduced": "TbDy2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.367312403319376,
"spacegroup": 12
},
{
"id": "oqmd-1558245",
"created_at": "2022-09-04T15:55:42.273284Z",
"updated_at": "2022-09-04T15:55:42.273310Z",
"structure_string": "Nd2 Sm2 Ho2 Se4 N2 O2\n1.0\n7.873986 -1.983030 0.000000\n7.873986 1.983030 0.000000\n-1.627729 0.000000 9.914822\nHo N Nd O Se Sm\n2 2 2 2 4 2\ndirect\n0.949918 0.949918 0.249361 Ho\n0.050082 0.050082 0.750639 Ho\n0.091411 0.091411 0.308896 N\n0.908589 0.908589 0.691104 N\n0.190020 0.190020 0.167938 Nd\n0.809980 0.809980 0.832062 Nd\n0.460702 0.460702 0.362353 O\n0.539298 0.539298 0.637647 O\n0.373375 0.373375 0.041896 Se\n0.784985 0.784985 0.350460 Se\n0.215015 0.215015 0.649540 Se\n0.626625 0.626625 0.958104 Se\n0.608344 0.608344 0.444738 Sm\n0.391656 0.391656 0.555262 Sm\n",
"nsites": 14,
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"elements": [
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"Nd",
"O",
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"Sm"
],
"chemical_system": "Ho-N-Nd-O-Se-Sm",
"density": 6.9446783560992875,
"density_atomic": 0.04521569342702445,
"volume": 309.6270108650485,
"volume_molar": 13.318696018052652,
"formula_full": "Nd2 Sm2 Ho2 Se4 N2 O2",
"formula_reduced": "NdSmHoSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.3261101038650835,
"spacegroup": 12
},
{
"id": "oqmd-1558427",
"created_at": "2022-09-04T15:55:42.072351Z",
"updated_at": "2022-09-04T15:55:42.072377Z",
"structure_string": "Gd2 Dy2 Ho2 Se4 N2 O2\n1.0\n7.753299 -1.952163 0.000000\n7.753299 1.952163 0.000000\n-1.189508 0.000000 9.600672\nDy Gd Ho N O Se\n2 2 2 2 2 4\ndirect\n0.391797 0.391797 0.055512 Dy\n0.608203 0.608203 0.944488 Dy\n0.044443 0.044443 0.262527 Gd\n0.955557 0.955557 0.737473 Gd\n0.802565 0.802565 0.324313 Ho\n0.197435 0.197435 0.675687 Ho\n0.901893 0.901893 0.187612 N\n0.098107 0.098107 0.812388 N\n0.535883 0.535883 0.138456 O\n0.464117 0.464117 0.861544 O\n0.213332 0.213332 0.150783 Se\n0.629834 0.629834 0.476474 Se\n0.370166 0.370166 0.523526 Se\n0.786668 0.786668 0.849217 Se\n",
"nsites": 14,
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"elements": [
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"Ho",
"N",
"O",
"Se"
],
"chemical_system": "Dy-Gd-Ho-N-O-Se",
"density": 7.686097043266946,
"density_atomic": 0.04817190239411981,
"volume": 290.62584835156804,
"volume_molar": 12.501355480482546,
"formula_full": "Gd2 Dy2 Ho2 Se4 N2 O2",
"formula_reduced": "GdDyHoSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.381438663388894,
"spacegroup": 12
},
{
"id": "oqmd-1558405",
"created_at": "2022-09-04T15:55:42.018770Z",
"updated_at": "2022-09-04T15:55:42.018790Z",
"structure_string": "Tb2 Gd2 Dy2 Se4 N2 O2\n1.0\n7.783997 -1.953660 0.000000\n7.783997 1.953660 0.000000\n-1.336791 0.000000 9.662619\nDy Gd N O Se Tb\n2 2 2 2 4 2\ndirect\n0.046042 0.046042 0.258895 Dy\n0.953958 0.953958 0.741105 Dy\n0.391303 0.391303 0.055731 Gd\n0.608697 0.608697 0.944269 Gd\n0.903976 0.903976 0.191178 N\n0.096024 0.096024 0.808822 N\n0.536826 0.536826 0.139463 O\n0.463174 0.463174 0.860537 O\n0.213344 0.213344 0.151697 Se\n0.628356 0.628356 0.469974 Se\n0.371644 0.371644 0.530026 Se\n0.786656 0.786656 0.848303 Se\n0.804785 0.804785 0.327948 Tb\n0.195215 0.195215 0.672052 Tb\n",
"nsites": 14,
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"elements": [
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],
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"density_atomic": 0.04763778279778102,
"volume": 293.8843744980533,
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"formula_full": "Tb2 Gd2 Dy2 Se4 N2 O2",
"formula_reduced": "TbGdDySe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.280730612865085,
"spacegroup": 12
},
{
"id": "oqmd-1558735",
"created_at": "2022-09-04T15:55:42.018234Z",
"updated_at": "2022-09-04T15:55:42.018265Z",
"structure_string": "Gd2 Ho2 Tm2 S4 N2 O2\n1.0\n7.542847 -1.899427 0.000000\n7.542847 1.899427 0.000000\n-1.681808 0.000000 9.384755\nGd Ho N O S Tm\n2 2 2 2 4 2\ndirect\n0.612448 0.612448 0.444040 Gd\n0.387552 0.387552 0.555960 Gd\n0.195270 0.195270 0.167181 Ho\n0.804730 0.804730 0.832819 Ho\n0.093956 0.093956 0.299845 N\n0.906044 0.906044 0.700155 N\n0.458933 0.458933 0.358651 O\n0.541067 0.541067 0.641349 O\n0.365713 0.365713 0.033639 S\n0.784399 0.784399 0.343837 S\n0.215601 0.215601 0.656163 S\n0.634287 0.634287 0.966361 S\n0.946951 0.946951 0.237958 Tm\n0.053049 0.053049 0.762042 Tm\n",
"nsites": 14,
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"elements": [
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"Tm"
],
"chemical_system": "Gd-Ho-N-O-S-Tm",
"density": 7.227866830828268,
"density_atomic": 0.052061562112931885,
"volume": 268.9124073847653,
"volume_molar": 11.567345495582286,
"formula_full": "Gd2 Ho2 Tm2 S4 N2 O2",
"formula_reduced": "GdHoTmS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.5712185664403284,
"spacegroup": 12
},
{
"id": "oqmd-1558111",
"created_at": "2022-09-04T15:55:42.024086Z",
"updated_at": "2022-09-04T15:55:42.024100Z",
"structure_string": "Nd2 Dy2 Er2 Se4 N2 O2\n1.0\n7.832203 -1.956776 0.000000\n7.832203 1.956776 0.000000\n-1.534945 0.000000 9.762859\nDy Er N Nd O Se\n2 2 2 2 2 4\ndirect\n0.191588 0.191588 0.167052 Dy\n0.808412 0.808412 0.832948 Dy\n0.952755 0.952755 0.241593 Er\n0.047245 0.047245 0.758407 Er\n0.094246 0.094246 0.300006 N\n0.905754 0.905754 0.699994 N\n0.611150 0.611150 0.444025 Nd\n0.388850 0.388850 0.555975 Nd\n0.461885 0.461885 0.356821 O\n0.538115 0.538115 0.643179 O\n0.370015 0.370015 0.034487 Se\n0.785568 0.785568 0.340450 Se\n0.214432 0.214432 0.659550 Se\n0.629985 0.629985 0.965513 Se\n",
"nsites": 14,
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"elements": [
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"N",
"Nd",
"O",
"Se"
],
"chemical_system": "Dy-Er-N-Nd-O-Se",
"density": 7.34610605636034,
"density_atomic": 0.046783851737155095,
"volume": 299.2485543656379,
"volume_molar": 12.872263690117029,
"formula_full": "Nd2 Dy2 Er2 Se4 N2 O2",
"formula_reduced": "NdDyErSe2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.341217655412705,
"spacegroup": 12
},
{
"id": "oqmd-1557958",
"created_at": "2022-09-04T15:55:42.001111Z",
"updated_at": "2022-09-04T15:55:42.001143Z",
"structure_string": "Tb2 Nd2 Gd2 S4 N2 O2\n1.0\n7.646625 -1.945029 0.000000\n7.646625 1.945029 0.000000\n-1.724649 0.000000 9.609048\nGd N Nd O S Tb\n2 2 2 2 4 2\ndirect\n0.611073 0.611073 0.446788 Gd\n0.388927 0.388927 0.553212 Gd\n0.093521 0.093521 0.309639 N\n0.906479 0.906479 0.690361 N\n0.194948 0.194948 0.168549 Nd\n0.805052 0.805052 0.831451 Nd\n0.459606 0.459606 0.362414 O\n0.540394 0.540394 0.637586 O\n0.369774 0.369774 0.036834 S\n0.785147 0.785147 0.351246 S\n0.214853 0.214853 0.648754 S\n0.630226 0.630226 0.963166 S\n0.946373 0.946373 0.241826 Tb\n0.053627 0.053627 0.758174 Tb\n",
"nsites": 14,
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"elements": [
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"O",
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],
"chemical_system": "Gd-N-Nd-O-S-Tb",
"density": 6.443417507671008,
"density_atomic": 0.04898034094646227,
"volume": 285.8289617726964,
"volume_molar": 12.295016007713123,
"formula_full": "Tb2 Nd2 Gd2 S4 N2 O2",
"formula_reduced": "TbNdGdS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.416611742345092,
"spacegroup": 12
},
{
"id": "oqmd-1557970",
"created_at": "2022-09-04T15:55:42.066479Z",
"updated_at": "2022-09-04T15:55:42.066509Z",
"structure_string": "Tb2 Ho4 Se2 S2 N2 O2\n1.0\n7.563657 -1.933488 0.000000\n7.563657 1.933488 0.000000\n-1.352090 0.000000 9.493033\nHo N O S Se Tb\n4 2 2 2 2 2\ndirect\n0.201133 0.201133 0.182641 Ho\n0.610867 0.610867 0.447453 Ho\n0.389133 0.389133 0.552547 Ho\n0.798867 0.798867 0.817359 Ho\n0.098680 0.098680 0.315971 N\n0.901320 0.901320 0.684029 N\n0.462393 0.462393 0.362174 O\n0.537607 0.537607 0.637826 O\n0.786239 0.786239 0.349787 S\n0.213761 0.213761 0.650213 S\n0.370241 0.370241 0.021976 Se\n0.629759 0.629759 0.978024 Se\n0.951978 0.951978 0.238994 Tb\n0.048022 0.048022 0.761006 Tb\n",
"nsites": 14,
"nelements": 6,
"elements": [
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"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-O-S-Se-Tb",
"density": 7.533299619036996,
"density_atomic": 0.05042196218610235,
"volume": 277.6567867059084,
"volume_molar": 11.943487517944837,
"formula_full": "Tb2 Ho4 Se2 S2 N2 O2",
"formula_reduced": "TbHo2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.393693312366993,
"spacegroup": 12
}
]
}