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{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-formula_anonymous&page=13",
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"results": [
{
"id": "oqmd-1557910",
"created_at": "2022-09-04T15:55:41.784508Z",
"updated_at": "2022-09-04T15:55:41.784529Z",
"structure_string": "Tb2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.566162 -1.931348 0.000000\n7.566162 1.931348 0.000000\n-1.511299 0.000000 9.552472\nDy Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.611369 0.611369 0.446797 Dy\n0.388631 0.388631 0.553203 Dy\n0.950381 0.950381 0.244008 Ho\n0.049619 0.049619 0.755992 Ho\n0.096638 0.096638 0.313365 N\n0.903362 0.903362 0.686635 N\n0.460876 0.460876 0.362400 O\n0.539124 0.539124 0.637600 O\n0.786080 0.786080 0.351162 S\n0.213920 0.213920 0.648838 S\n0.370858 0.370858 0.028882 Se\n0.629142 0.629142 0.971118 Se\n0.199144 0.199144 0.179282 Tb\n0.800856 0.800856 0.820718 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Ho",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Ho-N-O-S-Se-Tb",
"density": 7.46332768878795,
"density_atomic": 0.05014713161196088,
"volume": 279.1784804030701,
"volume_molar": 12.008943615358499,
"formula_full": "Tb2 Dy2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbDyHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3901218971288976,
"spacegroup": 12
},
{
"id": "oqmd-1558104",
"created_at": "2022-09-04T15:55:42.016277Z",
"updated_at": "2022-09-04T15:55:42.016305Z",
"structure_string": "Tb2 Nd2 Dy2 Se2 S2 N2 O2\n1.0\n7.681632 -1.960831 0.000000\n7.681632 1.960831 0.000000\n-1.505976 0.000000 9.701342\nDy N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.046963 0.046963 0.260475 Dy\n0.953037 0.953037 0.739525 Dy\n0.901774 0.901774 0.193494 N\n0.098226 0.098226 0.806506 N\n0.385286 0.385286 0.051631 Nd\n0.614714 0.614714 0.948369 Nd\n0.537803 0.537803 0.143937 O\n0.462197 0.462197 0.856063 O\n0.212837 0.212837 0.159708 S\n0.787163 0.787163 0.840292 S\n0.629187 0.629187 0.472640 Se\n0.370813 0.370813 0.527360 Se\n0.800489 0.800489 0.325286 Tb\n0.199511 0.199511 0.674714 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-N-Nd-O-S-Se-Tb",
"density": 6.894400460604532,
"density_atomic": 0.04790408650416397,
"volume": 292.250641263832,
"volume_molar": 12.57124642065043,
"formula_full": "Tb2 Nd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbNdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3422075609384225,
"spacegroup": 12
},
{
"id": "oqmd-1558181",
"created_at": "2022-09-04T15:55:41.565438Z",
"updated_at": "2022-09-04T15:55:41.565462Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.698245 -1.969571 0.000000\n7.698245 1.969571 0.000000\n-1.491898 0.000000 9.735319\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.199999 0.199999 0.175528 Gd\n0.800001 0.800001 0.824472 Gd\n0.098496 0.098496 0.308023 N\n0.901504 0.901504 0.691977 N\n0.614471 0.614471 0.448702 Nd\n0.385529 0.385529 0.551298 Nd\n0.462327 0.462327 0.356337 O\n0.537673 0.537673 0.643663 O\n0.787392 0.787392 0.341861 S\n0.212608 0.212608 0.658139 S\n0.371181 0.371181 0.026397 Se\n0.628819 0.628819 0.973603 Se\n0.953202 0.953202 0.239152 Tb\n0.046798 0.046798 0.760848 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Gd",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Gd-N-Nd-O-S-Se-Tb",
"density": 6.766030498155324,
"density_atomic": 0.047422504193497646,
"volume": 295.2184883125513,
"volume_molar": 12.698909225518564,
"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.336306594628898,
"spacegroup": 12
},
{
"id": "oqmd-1558012",
"created_at": "2022-09-04T15:55:41.346590Z",
"updated_at": "2022-09-04T15:55:41.346619Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.874747 -1.952498 0.000000\n7.874747 1.952498 0.000000\n-1.642879 0.000000 9.664094\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.190280 0.190280 0.160917 Gd\n0.809720 0.809720 0.839083 Gd\n0.092014 0.092014 0.294852 N\n0.907986 0.907986 0.705148 N\n0.609636 0.609636 0.441695 Nd\n0.390364 0.390364 0.558305 Nd\n0.460413 0.460413 0.356206 O\n0.539587 0.539587 0.643794 O\n0.365731 0.365731 0.034036 S\n0.634269 0.634269 0.965964 S\n0.784181 0.784181 0.342176 Se\n0.215819 0.215819 0.657824 Se\n0.948236 0.948236 0.234401 Tb\n0.051764 0.051764 0.765599 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Gd",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Gd-N-Nd-O-S-Se-Tb",
"density": 6.7213909136683325,
"density_atomic": 0.047109629327930974,
"volume": 297.1791584804404,
"volume_molar": 12.783248023625427,
"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.316020296771756,
"spacegroup": 12
},
{
"id": "oqmd-1558043",
"created_at": "2022-09-04T15:55:41.363814Z",
"updated_at": "2022-09-04T15:55:41.363849Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.705702 -1.970554 0.000000\n7.705702 1.970554 0.000000\n-1.450822 0.000000 9.718442\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.953451 0.953451 0.237274 Gd\n0.046549 0.046549 0.762726 Gd\n0.099250 0.099250 0.308032 N\n0.900750 0.900750 0.691968 N\n0.614608 0.614608 0.448713 Nd\n0.385392 0.385392 0.551287 Nd\n0.462616 0.462616 0.356407 O\n0.537384 0.537384 0.643593 O\n0.787053 0.787053 0.341094 S\n0.212947 0.212947 0.658906 S\n0.370071 0.370071 0.024123 Se\n0.629929 0.629929 0.975877 Se\n0.200490 0.200490 0.176441 Tb\n0.799510 0.799510 0.823559 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Gd",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Gd-N-Nd-O-S-Se-Tb",
"density": 6.767843540916449,
"density_atomic": 0.04743521164847673,
"volume": 295.1394020068545,
"volume_molar": 12.695507305053601,
"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.337535720343184,
"spacegroup": 12
},
{
"id": "oqmd-1558064",
"created_at": "2022-09-04T15:55:41.603969Z",
"updated_at": "2022-09-04T15:55:41.603997Z",
"structure_string": "Nd2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.622032 -1.974724 0.000000\n7.622032 1.974724 0.000000\n-0.672398 0.000000 9.517509\nDy Gd N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.386992 0.386992 0.046232 Dy\n0.613008 0.613008 0.953768 Dy\n0.787347 0.787347 0.314637 Gd\n0.212653 0.212653 0.685363 Gd\n0.891491 0.891491 0.171821 N\n0.108509 0.108509 0.828179 N\n0.032794 0.032794 0.273744 Nd\n0.967206 0.967206 0.726256 Nd\n0.530345 0.530345 0.142741 O\n0.469655 0.469655 0.857259 O\n0.206622 0.206622 0.153297 S\n0.793378 0.793378 0.846703 S\n0.623343 0.623343 0.498365 Se\n0.376657 0.376657 0.501635 Se\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"Gd",
"N",
"Nd",
"O",
"S",
"Se"
],
"chemical_system": "Dy-Gd-N-Nd-O-S-Se",
"density": 7.0132704311542,
"density_atomic": 0.04886496270517005,
"volume": 286.5038511227342,
"volume_molar": 12.32404656959421,
"formula_full": "Nd2 Gd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "NdGdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.4409635734860404,
"spacegroup": 12
},
{
"id": "oqmd-1558208",
"created_at": "2022-09-04T15:55:41.640405Z",
"updated_at": "2022-09-04T15:55:41.640429Z",
"structure_string": "Nd2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.625219 -1.956201 0.000000\n7.625219 1.956201 0.000000\n-1.519997 0.000000 9.706989\nDy Ho N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.951018 0.951018 0.249180 Dy\n0.048982 0.048982 0.750820 Dy\n0.609941 0.609941 0.449012 Ho\n0.390059 0.390059 0.550988 Ho\n0.096030 0.096030 0.320872 N\n0.903970 0.903970 0.679128 N\n0.198906 0.198906 0.179351 Nd\n0.801094 0.801094 0.820649 Nd\n0.461745 0.461745 0.365249 O\n0.538255 0.538255 0.634751 O\n0.787514 0.787514 0.356231 S\n0.212486 0.212486 0.643769 S\n0.375792 0.375792 0.033176 Se\n0.624208 0.624208 0.966824 Se\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Ho",
"N",
"Nd",
"O",
"S",
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],
"chemical_system": "Dy-Ho-N-Nd-O-S-Se",
"density": 7.026662051140653,
"density_atomic": 0.04834457031703832,
"volume": 289.58784633288815,
"volume_molar": 12.456705521442158,
"formula_full": "Nd2 Dy2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdDyHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.442565007890801,
"spacegroup": 12
},
{
"id": "oqmd-1558140",
"created_at": "2022-09-04T15:55:41.643133Z",
"updated_at": "2022-09-04T15:55:41.643156Z",
"structure_string": "Nd2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.611831 -1.973866 0.000000\n7.611831 1.973866 0.000000\n-0.610478 0.000000 9.493865\nGd Ho N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.786637 0.786637 0.313759 Gd\n0.213363 0.213363 0.686241 Gd\n0.387534 0.387534 0.046124 Ho\n0.612466 0.612466 0.953876 Ho\n0.891130 0.891130 0.170032 N\n0.108870 0.108870 0.829968 N\n0.031711 0.031711 0.274496 Nd\n0.968289 0.968289 0.725504 Nd\n0.529984 0.529984 0.142736 O\n0.470016 0.470016 0.857264 O\n0.206416 0.206416 0.152764 S\n0.793584 0.793584 0.847236 S\n0.377524 0.377524 0.499650 Se\n0.622476 0.622476 0.500350 Se\n",
"nsites": 14,
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"elements": [
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"Ho",
"N",
"Nd",
"O",
"S",
"Se"
],
"chemical_system": "Gd-Ho-N-Nd-O-S-Se",
"density": 7.071511033744669,
"density_atomic": 0.049073630027589826,
"volume": 285.28560027307987,
"volume_molar": 12.271643154611295,
"formula_full": "Nd2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.442859807295563,
"spacegroup": 12
},
{
"id": "oqmd-1558233",
"created_at": "2022-09-04T15:55:42.145459Z",
"updated_at": "2022-09-04T15:55:42.145474Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.675010 -1.972391 0.000000\n7.675010 1.972391 0.000000\n-1.451681 0.000000 9.744770\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.952527 0.952527 0.245405 Gd\n0.047473 0.047473 0.754595 Gd\n0.097707 0.097707 0.319936 N\n0.902293 0.902293 0.680064 N\n0.200778 0.200778 0.179700 Nd\n0.799222 0.799222 0.820300 Nd\n0.462743 0.462743 0.363726 O\n0.537257 0.537257 0.636274 O\n0.788279 0.788279 0.354491 S\n0.211721 0.211721 0.645509 S\n0.374992 0.374992 0.028902 Se\n0.625008 0.625008 0.971098 Se\n0.611051 0.611051 0.449772 Tb\n0.388949 0.388949 0.550228 Tb\n",
"nsites": 14,
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"elements": [
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"Nd",
"O",
"S",
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"Tb"
],
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"density": 6.770238249623098,
"density_atomic": 0.04745199594818011,
"volume": 295.0350079117574,
"volume_molar": 12.691016762659407,
"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.337714038914613,
"spacegroup": 12
},
{
"id": "oqmd-1558467",
"created_at": "2022-09-04T15:55:42.155645Z",
"updated_at": "2022-09-04T15:55:42.155678Z",
"structure_string": "Tb2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.613890 -1.949891 0.000000\n7.613890 1.949891 0.000000\n-1.305880 0.000000 9.560852\nDy Gd N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.202593 0.202593 0.181624 Dy\n0.797407 0.797407 0.818376 Dy\n0.954239 0.954239 0.237880 Gd\n0.045761 0.045761 0.762120 Gd\n0.099995 0.099995 0.315599 N\n0.900005 0.900005 0.684401 N\n0.463218 0.463218 0.360538 O\n0.536782 0.536782 0.639462 O\n0.787322 0.787322 0.348408 S\n0.212678 0.212678 0.651592 S\n0.370403 0.370403 0.021038 Se\n0.629597 0.629597 0.978962 Se\n0.612198 0.612198 0.448621 Tb\n0.387802 0.387802 0.551379 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"Gd",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Gd-N-O-S-Se-Tb",
"density": 7.249725876040528,
"density_atomic": 0.04931562161151067,
"volume": 283.8857048236473,
"volume_molar": 12.211426244284395,
"formula_full": "Tb2 Gd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbGdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3822478348669938,
"spacegroup": 12
},
{
"id": "oqmd-1557746",
"created_at": "2022-09-04T15:55:41.125657Z",
"updated_at": "2022-09-04T15:55:41.125679Z",
"structure_string": "Nd2 Y2 Er2 Se2 S2 N2 O2\n1.0\n7.826433 -1.932407 0.000000\n7.826433 1.932407 0.000000\n-1.672560 0.000000 9.597758\nEr N Nd O S Se Y\n2 2 2 2 2 2 2\ndirect\n0.051594 0.051594 0.265558 Er\n0.948406 0.948406 0.734442 Er\n0.908850 0.908850 0.208833 N\n0.091150 0.091150 0.791167 N\n0.390134 0.390134 0.059472 Nd\n0.609866 0.609866 0.940528 Nd\n0.540083 0.540083 0.145782 O\n0.459917 0.459917 0.854218 O\n0.634492 0.634492 0.464414 S\n0.365508 0.365508 0.535586 S\n0.215383 0.215383 0.159723 Se\n0.784617 0.784617 0.840277 Se\n0.809735 0.809735 0.340526 Y\n0.190265 0.190265 0.659474 Y\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Er",
"N",
"Nd",
"O",
"S",
"Se",
"Y"
],
"chemical_system": "Er-N-Nd-O-S-Se-Y",
"density": 6.19391899214906,
"density_atomic": 0.048224282076560196,
"volume": 290.3101797922838,
"volume_molar": 12.487776905500288,
"formula_full": "Nd2 Y2 Er2 Se2 S2 N2 O2",
"formula_reduced": "NdYErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.4165046593193744,
"spacegroup": 12
},
{
"id": "oqmd-1558139",
"created_at": "2022-09-04T15:55:41.792349Z",
"updated_at": "2022-09-04T15:55:41.792373Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.672744 -1.958492 0.000000\n7.672744 1.958492 0.000000\n-1.457332 0.000000 9.673526\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.799897 0.799897 0.323853 Ho\n0.200103 0.200103 0.676147 Ho\n0.900818 0.900818 0.193832 N\n0.099182 0.099182 0.806168 N\n0.385126 0.385126 0.051772 Nd\n0.614874 0.614874 0.948228 Nd\n0.537648 0.537648 0.144468 O\n0.462352 0.462352 0.855532 O\n0.213195 0.213195 0.161276 S\n0.786805 0.786805 0.838724 S\n0.630949 0.630949 0.476120 Se\n0.369051 0.369051 0.523880 Se\n0.046507 0.046507 0.263300 Tb\n0.953493 0.953493 0.736700 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Ho",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 6.958263908361507,
"density_atomic": 0.048154926750715164,
"volume": 290.7283001898052,
"volume_molar": 12.50576247613244,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.345229732605088,
"spacegroup": 12
}
]
}