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{
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"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-nelements&page=16",
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"results": [
{
"id": "oqmd-1558052",
"created_at": "2022-09-04T15:55:41.302218Z",
"updated_at": "2022-09-04T15:55:41.302242Z",
"structure_string": "Nd2 Gd2 Dy2 Se2 S2 N2 O2\n1.0\n7.864901 -1.948167 0.000000\n7.864901 1.948167 0.000000\n-1.683386 0.000000 9.660917\nDy Gd N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.947665 0.947665 0.235428 Dy\n0.052335 0.052335 0.764572 Dy\n0.189193 0.189193 0.160312 Gd\n0.810807 0.810807 0.839688 Gd\n0.091057 0.091057 0.294232 N\n0.908943 0.908943 0.705768 N\n0.609480 0.609480 0.441542 Nd\n0.390520 0.390520 0.558458 Nd\n0.459869 0.459869 0.356083 O\n0.540131 0.540131 0.643917 O\n0.365925 0.365925 0.035503 S\n0.634075 0.634075 0.964497 S\n0.783843 0.783843 0.341922 Se\n0.216157 0.216157 0.658078 Se\n",
"nsites": 14,
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"elements": [
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"density": 6.787084561076354,
"density_atomic": 0.04728901262392224,
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"volume_molar": 12.734756819501792,
"formula_full": "Nd2 Gd2 Dy2 Se2 S2 N2 O2",
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"formula_anonymous": "ABCDEFG",
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"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": [
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"Nd",
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],
"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-1557955",
"created_at": "2022-09-04T15:55:41.446730Z",
"updated_at": "2022-09-04T15:55:41.446748Z",
"structure_string": "Tb2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.723774 -1.922005 0.000000\n7.723774 1.922005 0.000000\n-1.491332 0.000000 9.451524\nDy Ho N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.948331 0.948331 0.235771 Dy\n0.051669 0.051669 0.764229 Dy\n0.606242 0.606242 0.440923 Ho\n0.393758 0.393758 0.559077 Ho\n0.092898 0.092898 0.304287 N\n0.907102 0.907102 0.695713 N\n0.460868 0.460868 0.361505 O\n0.539132 0.539132 0.638495 O\n0.367504 0.367504 0.031560 S\n0.632496 0.632496 0.968440 S\n0.785076 0.785076 0.351410 Se\n0.214924 0.214924 0.648590 Se\n0.192389 0.192389 0.166318 Tb\n0.807611 0.807611 0.833682 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"Ho",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Ho-N-O-S-Se-Tb",
"density": 7.425035620442552,
"density_atomic": 0.049889841905400675,
"volume": 280.61824742893145,
"volume_molar": 12.07087561315381,
"formula_full": "Tb2 Dy2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbDyHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3699192107003264,
"spacegroup": 12
},
{
"id": "oqmd-1558144",
"created_at": "2022-09-04T15:55:41.452249Z",
"updated_at": "2022-09-04T15:55:41.452267Z",
"structure_string": "Tb2 Nd2 Dy2 Se2 S2 N2 O2\n1.0\n7.683426 -1.961848 0.000000\n7.683426 1.961848 0.000000\n-1.467403 0.000000 9.689560\nDy N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.799925 0.799925 0.324036 Dy\n0.200075 0.200075 0.675964 Dy\n0.901034 0.901034 0.193273 N\n0.098966 0.098966 0.806727 N\n0.385249 0.385249 0.051579 Nd\n0.614751 0.614751 0.948421 Nd\n0.537600 0.537600 0.144213 O\n0.462400 0.462400 0.855787 O\n0.213037 0.213037 0.160075 S\n0.786963 0.786963 0.839925 S\n0.630195 0.630195 0.475316 Se\n0.369805 0.369805 0.524684 Se\n0.046601 0.046601 0.262530 Tb\n0.953399 0.953399 0.737470 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-N-Nd-O-S-Se-Tb",
"density": 6.89759447397903,
"density_atomic": 0.047926279339329504,
"volume": 292.11531111932675,
"volume_molar": 12.565425155084135,
"formula_full": "Tb2 Nd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbNdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.343392694509851,
"spacegroup": 12
},
{
"id": "oqmd-1557807",
"created_at": "2022-09-04T15:55:41.483872Z",
"updated_at": "2022-09-04T15:55:41.483902Z",
"structure_string": "Tb2 Dy2 Er2 Se2 S2 N2 O2\n1.0\n7.713199 -1.913693 0.000000\n7.713199 1.913693 0.000000\n-1.573142 0.000000 9.453546\nDy Er N O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.808806 0.808806 0.336570 Dy\n0.191194 0.191194 0.663430 Dy\n0.052186 0.052186 0.263958 Er\n0.947814 0.947814 0.736042 Er\n0.908000 0.908000 0.201191 N\n0.092000 0.092000 0.798809 N\n0.540060 0.540060 0.140785 O\n0.459940 0.459940 0.859215 O\n0.632987 0.632987 0.465791 S\n0.367013 0.367013 0.534209 S\n0.215276 0.215276 0.152239 Se\n0.784724 0.784724 0.847761 Se\n0.392643 0.392643 0.059696 Tb\n0.607357 0.607357 0.940304 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"Er",
"N",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-Er-N-O-S-Se-Tb",
"density": 7.493624030651123,
"density_atomic": 0.050164500666906524,
"volume": 279.0818170993136,
"volume_molar": 12.004785615204582,
"formula_full": "Tb2 Dy2 Er2 Se2 S2 N2 O2",
"formula_reduced": "TbDyErSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3703879495098508,
"spacegroup": 12
},
{
"id": "oqmd-1558256",
"created_at": "2022-09-04T15:55:42.212225Z",
"updated_at": "2022-09-04T15:55:42.212235Z",
"structure_string": "Tb2 Nd2 Dy2 Se2 S2 N2 O2\n1.0\n7.806934 -1.951799 0.000000\n7.806934 1.951799 0.000000\n-1.650286 0.000000 9.665976\nDy N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.394856 0.394856 0.058317 Dy\n0.605144 0.605144 0.941683 Dy\n0.909914 0.909914 0.191884 N\n0.090086 0.090086 0.808116 N\n0.810658 0.810658 0.335064 Nd\n0.189342 0.189342 0.664936 Nd\n0.540404 0.540404 0.135350 O\n0.459596 0.459596 0.864650 O\n0.630433 0.630433 0.460398 S\n0.369567 0.369567 0.539602 S\n0.216186 0.216186 0.144529 Se\n0.783814 0.783814 0.855471 Se\n0.054260 0.054260 0.256951 Tb\n0.945740 0.945740 0.743049 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Dy",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Dy-N-Nd-O-S-Se-Tb",
"density": 6.840071971237495,
"density_atomic": 0.047526598038103655,
"volume": 294.5718940113436,
"volume_molar": 12.671095783400801,
"formula_full": "Tb2 Nd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbNdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.326971165938422,
"spacegroup": 12
},
{
"id": "oqmd-1558198",
"created_at": "2022-09-04T15:55:41.626956Z",
"updated_at": "2022-09-04T15:55:41.626984Z",
"structure_string": "Tb2 Nd2 Gd2 Se2 S2 N2 O2\n1.0\n7.833626 -1.960004 0.000000\n7.833626 1.960004 0.000000\n-1.634112 0.000000 9.692861\nGd N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.053843 0.053843 0.258653 Gd\n0.946157 0.946157 0.741347 Gd\n0.909285 0.909285 0.192505 N\n0.090715 0.090715 0.807495 N\n0.809839 0.809839 0.334765 Nd\n0.190161 0.190161 0.665235 Nd\n0.540035 0.540035 0.136051 O\n0.459965 0.459965 0.863949 O\n0.631151 0.631151 0.461848 S\n0.368849 0.368849 0.538152 S\n0.215980 0.215980 0.145029 Se\n0.784020 0.784020 0.854971 Se\n0.394402 0.394402 0.058034 Tb\n0.605598 0.605598 0.941966 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Gd",
"N",
"Nd",
"O",
"S",
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],
"chemical_system": "Gd-N-Nd-O-S-Se-Tb",
"density": 6.710822187821765,
"density_atomic": 0.04703555407126232,
"volume": 297.6471793824087,
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"formula_full": "Tb2 Nd2 Gd2 Se2 S2 N2 O2",
"formula_reduced": "TbNdGdSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.320485873200327,
"spacegroup": 12
},
{
"id": "oqmd-1558025",
"created_at": "2022-09-04T15:55:41.617469Z",
"updated_at": "2022-09-04T15:55:41.617493Z",
"structure_string": "Nd2 Dy2 Ho2 Se2 S2 N2 O2\n1.0\n7.782190 -1.954396 0.000000\n7.782190 1.954396 0.000000\n-1.151021 0.000000 9.478807\nDy Ho N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.197929 0.197929 0.172127 Dy\n0.802071 0.802071 0.827873 Dy\n0.606718 0.606718 0.443321 Ho\n0.393282 0.393282 0.556679 Ho\n0.098938 0.098938 0.311476 N\n0.901062 0.901062 0.688524 N\n0.953398 0.953398 0.226177 Nd\n0.046602 0.046602 0.773823 Nd\n0.464213 0.464213 0.361383 O\n0.535787 0.535787 0.638617 O\n0.366137 0.366137 0.017565 S\n0.633863 0.633863 0.982435 S\n0.786391 0.786391 0.350004 Se\n0.213609 0.213609 0.649996 Se\n",
"nsites": 14,
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"elements": [
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],
"chemical_system": "Dy-Ho-N-Nd-O-S-Se",
"density": 7.057182141917619,
"density_atomic": 0.04855455347318143,
"volume": 288.3354700755871,
"volume_molar": 12.402834192113954,
"formula_full": "Nd2 Dy2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdDyHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.4261560450336583,
"spacegroup": 12
},
{
"id": "oqmd-1558159",
"created_at": "2022-09-04T15:55:41.709839Z",
"updated_at": "2022-09-04T15:55:41.709859Z",
"structure_string": "Nd2 Gd2 Ho2 Se2 S2 N2 O2\n1.0\n7.651738 -1.966592 0.000000\n7.651738 1.966592 0.000000\n-1.412998 0.000000 9.708912\nGd Ho N Nd O S Se\n2 2 2 2 2 2 2\ndirect\n0.952563 0.952563 0.245896 Gd\n0.047437 0.047437 0.754104 Gd\n0.609918 0.609918 0.449470 Ho\n0.390082 0.390082 0.550530 Ho\n0.097655 0.097655 0.322305 N\n0.902345 0.902345 0.677695 N\n0.201206 0.201206 0.181195 Nd\n0.798794 0.798794 0.818805 Nd\n0.462750 0.462750 0.365005 O\n0.537250 0.537250 0.634995 O\n0.788416 0.788416 0.356477 S\n0.211584 0.211584 0.643523 S\n0.375265 0.375265 0.028383 Se\n0.624735 0.624735 0.971617 Se\n",
"nsites": 14,
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"elements": [
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"density": 6.904260275864669,
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"formula_full": "Nd2 Gd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "NdGdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.434910417295563,
"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,
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"elements": [
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"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-1558235",
"created_at": "2022-09-04T15:55:41.668491Z",
"updated_at": "2022-09-04T15:55:41.668518Z",
"structure_string": "Tb2 Nd2 Dy2 Se2 S2 N2 O2\n1.0\n7.620700 -1.971467 0.000000\n7.620700 1.971467 0.000000\n-0.765535 0.000000 9.521468\nDy N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.211341 0.211341 0.185673 Dy\n0.788659 0.788659 0.814327 Dy\n0.108373 0.108373 0.324957 N\n0.891627 0.891627 0.675043 N\n0.965590 0.965590 0.226018 Nd\n0.034410 0.034410 0.773982 Nd\n0.468848 0.468848 0.356984 O\n0.531152 0.531152 0.643016 O\n0.792197 0.792197 0.344655 S\n0.207803 0.207803 0.655345 S\n0.373755 0.373755 0.003207 Se\n0.626245 0.626245 0.996793 Se\n0.613496 0.613496 0.452870 Tb\n0.386504 0.386504 0.547130 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
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"Nd",
"O",
"S",
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],
"chemical_system": "Dy-N-Nd-O-S-Se-Tb",
"density": 7.042610882751975,
"density_atomic": 0.0489338910424903,
"volume": 286.10028145612847,
"volume_molar": 12.306686902888737,
"formula_full": "Tb2 Nd2 Dy2 Se2 S2 N2 O2",
"formula_reduced": "TbNdDySeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.3535394795098514,
"spacegroup": 12
},
{
"id": "oqmd-1558084",
"created_at": "2022-09-04T15:55:39.319293Z",
"updated_at": "2022-09-04T15:55:39.319312Z",
"structure_string": "Tb2 Nd2 Ho2 Se2 S2 N2 O2\n1.0\n7.672929 -1.956121 0.000000\n7.672929 1.956121 0.000000\n-1.543232 0.000000 9.697019\nHo N Nd O S Se Tb\n2 2 2 2 2 2 2\ndirect\n0.952722 0.952722 0.240945 Ho\n0.047278 0.047278 0.759055 Ho\n0.097615 0.097615 0.305579 N\n0.902385 0.902385 0.694421 N\n0.614781 0.614781 0.448176 Nd\n0.385219 0.385219 0.551824 Nd\n0.462013 0.462013 0.356294 O\n0.537987 0.537987 0.643706 O\n0.786923 0.786923 0.339949 S\n0.213077 0.213077 0.660051 S\n0.371130 0.371130 0.029305 Se\n0.628870 0.628870 0.970695 Se\n0.198719 0.198719 0.173692 Tb\n0.801281 0.801281 0.826308 Tb\n",
"nsites": 14,
"nelements": 7,
"elements": [
"Ho",
"N",
"Nd",
"O",
"S",
"Se",
"Tb"
],
"chemical_system": "Ho-N-Nd-O-S-Se-Tb",
"density": 6.949652161795393,
"density_atomic": 0.04809532883512179,
"volume": 291.08855972259096,
"volume_molar": 12.521259144822212,
"formula_full": "Tb2 Nd2 Ho2 Se2 S2 N2 O2",
"formula_reduced": "TbNdHoSeSNO",
"formula_anonymous": "ABCDEFG",
"formation_energy": -2.34317324403366,
"spacegroup": 12
}
]
}