HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 1013513,
"next": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-nelements&page=53",
"previous": "https://simmate.org/third-parties/OqmdStructure/?format=api&ordering=-nelements&page=51",
"results": [
{
"id": "oqmd-1487901",
"created_at": "2022-09-04T15:53:04.015267Z",
"updated_at": "2022-09-04T15:53:04.015282Z",
"structure_string": "Cs2 Tl2 Ge2 Se2 S2 O2\n1.0\n6.976234 0.000000 0.000000\n2.989599 6.371978 0.000000\n3.223957 -0.843804 8.509063\nCs Ge O S Se Tl\n2 2 2 2 2 2\ndirect\n0.270735 0.348101 0.109744 Cs\n0.729265 0.651899 0.890256 Cs\n0.561695 0.567092 0.321007 Ge\n0.438305 0.432908 0.678993 Ge\n0.691612 0.387386 0.157519 O\n0.308388 0.612614 0.842481 O\n0.468850 0.902548 0.288276 S\n0.531150 0.097452 0.711724 S\n0.781086 0.455250 0.494997 Se\n0.218914 0.544750 0.505003 Se\n0.828991 0.996295 0.351786 Tl\n0.171009 0.003705 0.648214 Tl\n",
"nsites": 12,
"nelements": 6,
"elements": [
"Cs",
"Ge",
"O",
"S",
"Se",
"Tl"
],
"chemical_system": "Cs-Ge-O-S-Se-Tl",
"density": 4.714530425942663,
"density_atomic": 0.03172518766489542,
"volume": 378.24835354018256,
"volume_molar": 18.982206893810197,
"formula_full": "Cs2 Tl2 Ge2 Se2 S2 O2",
"formula_reduced": "CsTlGeSeSO",
"formula_anonymous": "ABCDEF",
"formation_energy": -0.9968791783153522,
"spacegroup": 2
},
{
"id": "oqmd-1557702",
"created_at": "2022-09-04T15:55:39.949514Z",
"updated_at": "2022-09-04T15:55:39.949546Z",
"structure_string": "Nd2 Er2 Tm2 S4 N2 O2\n1.0\n7.612155 -1.908113 0.000000\n7.612155 1.908113 0.000000\n-1.679213 0.000000 9.431030\nEr N Nd O S Tm\n2 2 2 2 4 2\ndirect\n0.947205 0.947205 0.231894 Er\n0.052795 0.052795 0.768106 Er\n0.093940 0.093940 0.291826 N\n0.906060 0.906060 0.708174 N\n0.614028 0.614028 0.443682 Nd\n0.385972 0.385972 0.556318 Nd\n0.459057 0.459057 0.353523 O\n0.540943 0.540943 0.646477 O\n0.363028 0.363028 0.030196 S\n0.784291 0.784291 0.335555 S\n0.215709 0.215709 0.664445 S\n0.636972 0.636972 0.969804 S\n0.195953 0.195953 0.165154 Tm\n0.804047 0.804047 0.834846 Tm\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Er",
"N",
"Nd",
"O",
"S",
"Tm"
],
"chemical_system": "Er-N-Nd-O-S-Tm",
"density": 6.965017219519618,
"density_atomic": 0.05110074130639452,
"volume": 273.96862828383473,
"volume_molar": 11.784840309638358,
"formula_full": "Nd2 Er2 Tm2 S4 N2 O2",
"formula_reduced": "NdErTmS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.525908376321282,
"spacegroup": 12
},
{
"id": "oqmd-1557725",
"created_at": "2022-09-04T15:55:38.011470Z",
"updated_at": "2022-09-04T15:55:38.011496Z",
"structure_string": "Dy2 Er4 Se2 S2 N2 O2\n1.0\n7.506443 -1.916041 0.000000\n7.506443 1.916041 0.000000\n-1.517148 0.000000 9.483188\nDy Er N O S Se\n2 4 2 2 2 2\ndirect\n0.801444 0.801444 0.319969 Dy\n0.198556 0.198556 0.680031 Dy\n0.389448 0.389448 0.054092 Er\n0.050624 0.050624 0.254544 Er\n0.949376 0.949376 0.745456 Er\n0.610552 0.610552 0.945908 Er\n0.904366 0.904366 0.186245 N\n0.095634 0.095634 0.813755 N\n0.540064 0.540064 0.136246 O\n0.459936 0.459936 0.863754 O\n0.214663 0.214663 0.147477 S\n0.785337 0.785337 0.852523 S\n0.629627 0.629627 0.470315 Se\n0.370373 0.370373 0.529685 Se\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Dy",
"Er",
"N",
"O",
"S",
"Se"
],
"chemical_system": "Dy-Er-N-O-S-Se",
"density": 7.768011295189754,
"density_atomic": 0.05132213214115993,
"volume": 272.7867961816831,
"volume_molar": 11.734003457682327,
"formula_full": "Dy2 Er4 Se2 S2 N2 O2",
"formula_reduced": "DyEr2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.492147480271754,
"spacegroup": 12
},
{
"id": "oqmd-1557723",
"created_at": "2022-09-04T15:55:39.699795Z",
"updated_at": "2022-09-04T15:55:39.699820Z",
"structure_string": "Gd2 Er4 Se2 S2 N2 O2\n1.0\n7.719072 -1.910746 0.000000\n7.719072 1.910746 0.000000\n-1.561018 0.000000 9.421995\nEr Gd N O S Se\n4 2 2 2 2 2\ndirect\n0.051416 0.051416 0.266198 Er\n0.808058 0.808058 0.336428 Er\n0.191942 0.191942 0.663572 Er\n0.948584 0.948584 0.733802 Er\n0.391935 0.391935 0.059774 Gd\n0.608065 0.608065 0.940226 Gd\n0.907461 0.907461 0.203613 N\n0.092539 0.092539 0.796387 N\n0.539713 0.539713 0.142790 O\n0.460287 0.460287 0.857210 O\n0.634773 0.634773 0.468126 S\n0.365227 0.365227 0.531874 S\n0.215086 0.215086 0.154417 Se\n0.784914 0.784914 0.845583 Se\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Er",
"Gd",
"N",
"O",
"S",
"Se"
],
"chemical_system": "Er-Gd-N-O-S-Se",
"density": 7.561431634362659,
"density_atomic": 0.05037175932375621,
"volume": 277.9335125068255,
"volume_molar": 11.955390958838024,
"formula_full": "Gd2 Er4 Se2 S2 N2 O2",
"formula_reduced": "GdEr2SeSNO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.46228652896223,
"spacegroup": 12
},
{
"id": "oqmd-1528474",
"created_at": "2022-09-04T15:55:07.816557Z",
"updated_at": "2022-09-04T15:55:07.816574Z",
"structure_string": "La1 Pr1 Nd1 Gd1 Zn12 Ge6\n1.0\n7.667901 0.000000 0.000000\n0.000000 4.100983 0.000000\n-0.001370 0.000000 13.283156\nGd Ge La Nd Pr Zn\n1 6 1 1 1 12\ndirect\n0.000444 0.000000 0.666220 Gd\n0.381190 0.500000 0.000820 Ge\n0.808153 0.500000 0.190796 Ge\n0.310124 0.500000 0.309025 Ge\n0.882921 0.500000 0.502502 Ge\n0.304642 0.500000 0.689693 Ge\n0.812701 0.500000 0.807253 Ge\n0.499754 0.000000 0.832888 La\n0.499526 0.000000 0.167115 Nd\n0.000246 0.000000 0.333802 Pr\n0.711684 0.500000 0.000000 Zn\n0.188997 0.000000 0.001170 Zn\n0.904609 0.000000 0.094105 Zn\n0.144294 0.500000 0.145004 Zn\n0.645193 0.500000 0.355838 Zn\n0.406286 0.000000 0.405378 Zn\n0.209817 0.500000 0.500113 Zn\n0.689490 0.000000 0.501575 Zn\n0.402013 0.000000 0.593634 Zn\n0.645198 0.500000 0.644216 Zn\n0.143843 0.500000 0.854757 Zn\n0.908778 0.000000 0.904064 Zn\n",
"nsites": 22,
"nelements": 6,
"elements": [
"Gd",
"Ge",
"La",
"Nd",
"Pr",
"Zn"
],
"chemical_system": "Gd-Ge-La-Nd-Pr-Zn",
"density": 7.163923622649376,
"density_atomic": 0.05266922665501885,
"volume": 417.7012156282272,
"volume_molar": 11.433888709710436,
"formula_full": "La1 Pr1 Nd1 Gd1 Zn12 Ge6",
"formula_reduced": "LaPrNdGd(Zn2Ge)6",
"formula_anonymous": "ABCDE6F12",
"formation_energy": -0.4225149949999999,
"spacegroup": 6
},
{
"id": "oqmd-1527907",
"created_at": "2022-09-04T15:54:44.892921Z",
"updated_at": "2022-09-04T15:54:44.892941Z",
"structure_string": "Sr4 Ca2 Yb1 Sn2 Pb1 N2\n1.0\n2.457431 -12.502773 0.000000\n2.457431 12.502773 0.000000\n0.000000 0.000000 5.284654\nCa N Pb Sn Sr Yb\n2 2 1 2 4 1\ndirect\n0.906716 0.093284 0.500000 Ca\n0.093284 0.906716 0.500000 Ca\n0.599166 0.400834 0.500000 N\n0.400834 0.599166 0.500000 N\n0.000000 0.000000 0.000000 Pb\n0.790508 0.209492 0.000000 Sn\n0.209492 0.790508 0.000000 Sn\n0.595850 0.404150 0.000000 Sr\n0.404150 0.595850 0.000000 Sr\n0.697210 0.302790 0.500000 Sr\n0.302790 0.697210 0.500000 Sr\n0.500000 0.500000 0.500000 Yb\n",
"nsites": 12,
"nelements": 6,
"elements": [
"Ca",
"N",
"Pb",
"Sn",
"Sr",
"Yb"
],
"chemical_system": "Ca-N-Pb-Sn-Sr-Yb",
"density": 5.503665088073775,
"density_atomic": 0.03695277123964377,
"volume": 324.7388381828892,
"volume_molar": 16.296858281468513,
"formula_full": "Sr4 Ca2 Yb1 Sn2 Pb1 N2",
"formula_reduced": "Sr4Ca2YbSn2PbN2",
"formula_anonymous": "ABC2D2E2F4",
"formation_energy": -0.773334834532451,
"spacegroup": 65
},
{
"id": "oqmd-1488228",
"created_at": "2022-09-04T15:53:04.034303Z",
"updated_at": "2022-09-04T15:53:04.034327Z",
"structure_string": "K2 Rb2 Si2 Se2 S2 O2\n1.0\n6.825950 0.000000 0.000000\n3.338189 6.264747 0.000000\n0.642726 2.903548 7.285871\nK O Rb S Se Si\n2 2 2 2 2 2\ndirect\n0.241368 0.283628 0.131495 K\n0.758632 0.716372 0.868505 K\n0.829062 0.509679 0.256713 O\n0.170938 0.490321 0.743287 O\n0.942343 0.812845 0.346594 Rb\n0.057657 0.187155 0.653406 Rb\n0.327251 0.783483 0.069685 S\n0.672749 0.216517 0.930315 S\n0.534506 0.252097 0.479128 Se\n0.465494 0.747903 0.520872 Se\n0.574176 0.577266 0.291013 Si\n0.425824 0.422734 0.708987 Si\n",
"nsites": 12,
"nelements": 6,
"elements": [
"K",
"O",
"Rb",
"S",
"Se",
"Si"
],
"chemical_system": "K-O-Rb-S-Se-Si",
"density": 2.981166110479144,
"density_atomic": 0.038515286157806805,
"volume": 311.5646071233376,
"volume_molar": 15.635715999423649,
"formula_full": "K2 Rb2 Si2 Se2 S2 O2",
"formula_reduced": "KRbSiSeSO",
"formula_anonymous": "ABCDEF",
"formation_energy": -1.5345572958153522,
"spacegroup": 2
},
{
"id": "oqmd-1527971",
"created_at": "2022-09-04T15:54:49.014888Z",
"updated_at": "2022-09-04T15:54:49.014915Z",
"structure_string": "Sr1 Ca2 Yb2 Pr2 Pb3 N2\n1.0\n2.464693 -12.708960 0.000000\n2.464693 12.708960 0.000000\n0.000000 0.000000 5.026748\nCa N Pb Pr Sr Yb\n2 2 3 2 1 2\ndirect\n0.800626 0.199374 0.000000 Ca\n0.199374 0.800626 0.000000 Ca\n0.894823 0.105177 0.000000 N\n0.105177 0.894823 0.000000 N\n0.694896 0.305104 0.500000 Pb\n0.500000 0.500000 0.500000 Pb\n0.305104 0.694896 0.500000 Pb\n0.900398 0.099602 0.500000 Pr\n0.099602 0.900398 0.500000 Pr\n0.000000 0.000000 0.000000 Sr\n0.604278 0.395722 0.000000 Yb\n0.395722 0.604278 0.000000 Yb\n",
"nsites": 12,
"nelements": 6,
"elements": [
"Ca",
"N",
"Pb",
"Pr",
"Sr",
"Yb"
],
"chemical_system": "Ca-N-Pb-Pr-Sr-Yb",
"density": 7.621010302730311,
"density_atomic": 0.0381058182867188,
"volume": 314.9125393321475,
"volume_molar": 15.803730324560238,
"formula_full": "Sr1 Ca2 Yb2 Pr2 Pb3 N2",
"formula_reduced": "SrCa2Yb2Pr2Pb3N2",
"formula_anonymous": "AB2C2D2E2F3",
"formation_energy": -0.7949237846405843,
"spacegroup": 65
},
{
"id": "oqmd-1557965",
"created_at": "2022-09-04T15:55:38.814479Z",
"updated_at": "2022-09-04T15:55:38.814495Z",
"structure_string": "Tb2 Ho2 Tm2 S4 N2 O2\n1.0\n7.514010 -1.903710 0.000000\n7.514010 1.903710 0.000000\n-1.462941 0.000000 9.309304\nHo N O S Tb Tm\n2 2 2 4 2 2\ndirect\n0.800796 0.800796 0.325277 Ho\n0.199204 0.199204 0.674723 Ho\n0.903232 0.903232 0.190047 N\n0.096768 0.096768 0.809953 N\n0.539683 0.539683 0.138048 O\n0.460317 0.460317 0.861952 O\n0.214966 0.214966 0.149066 S\n0.634798 0.634798 0.474820 S\n0.365202 0.365202 0.525180 S\n0.785034 0.785034 0.850934 S\n0.051665 0.051665 0.265684 Tb\n0.948335 0.948335 0.734316 Tb\n0.390071 0.390071 0.055365 Tm\n0.609929 0.609929 0.944635 Tm\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Ho",
"N",
"O",
"S",
"Tb",
"Tm"
],
"chemical_system": "Ho-N-O-S-Tb-Tm",
"density": 7.318846836918112,
"density_atomic": 0.052566403871955276,
"volume": 266.32980323520184,
"volume_molar": 11.456254026182062,
"formula_full": "Tb2 Ho2 Tm2 S4 N2 O2",
"formula_reduced": "TbHoTmS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.482382605321281,
"spacegroup": 12
},
{
"id": "oqmd-1557428",
"created_at": "2022-09-04T15:55:49.098738Z",
"updated_at": "2022-09-04T15:55:49.098767Z",
"structure_string": "Ho2 Er2 Tm2 S4 N2 O2\n1.0\n7.486396 -1.887379 0.000000\n7.486396 1.887379 0.000000\n-1.556771 0.000000 9.277477\nEr Ho N O S Tm\n2 2 2 2 4 2\ndirect\n0.052989 0.052989 0.262329 Er\n0.947011 0.947011 0.737671 Er\n0.802474 0.802474 0.327765 Ho\n0.197526 0.197526 0.672235 Ho\n0.905288 0.905288 0.193572 N\n0.094712 0.094712 0.806428 N\n0.540372 0.540372 0.137946 O\n0.459628 0.459628 0.862054 O\n0.214916 0.214916 0.149596 S\n0.634406 0.634406 0.469332 S\n0.365594 0.365594 0.530668 S\n0.785084 0.785084 0.850404 S\n0.390263 0.390263 0.056593 Tm\n0.609737 0.609737 0.943407 Tm\n",
"nsites": 14,
"nelements": 6,
"elements": [
"Er",
"Ho",
"N",
"O",
"S",
"Tm"
],
"chemical_system": "Er-Ho-N-O-S-Tm",
"density": 7.540388576928483,
"density_atomic": 0.05339938303515782,
"volume": 262.1753137256752,
"volume_molar": 11.27754745037983,
"formula_full": "Ho2 Er2 Tm2 S4 N2 O2",
"formula_reduced": "HoErTmS2NO",
"formula_anonymous": "ABCDEF2",
"formation_energy": -2.586251161083186,
"spacegroup": 12
},
{
"id": "oqmd-1527220",
"created_at": "2022-09-04T15:54:40.497269Z",
"updated_at": "2022-09-04T15:54:40.497295Z",
"structure_string": "Dy1 Y2 Er2 Tm2 Ni2 Te2\n1.0\n-1.919106 7.757957 4.784955\n1.919106 -7.757957 4.784955\n1.919106 7.757957 -4.784955\nDy Er Ni Te Tm Y\n1 2 2 2 2 2\ndirect\n0.475943 0.475943 0.000000 Dy\n0.410880 0.096530 0.314350 Er\n0.782179 0.096530 0.685650 Er\n0.639814 0.404403 0.235411 Ni\n0.168992 0.404403 0.764589 Ni\n0.142798 0.142798 0.000000 Te\n0.739391 0.239391 0.500000 Te\n0.100700 0.747931 0.352769 Tm\n0.395162 0.747931 0.647231 Tm\n0.026603 0.895130 0.131473 Y\n0.763657 0.895130 0.868527 Y\n",
"nsites": 11,
"nelements": 6,
"elements": [
"Dy",
"Er",
"Ni",
"Te",
"Tm",
"Y"
],
"chemical_system": "Dy-Er-Ni-Te-Tm-Y",
"density": 8.072425089663,
"density_atomic": 0.03860188429643521,
"volume": 284.9601826565711,
"volume_molar": 15.600639372301654,
"formula_full": "Dy1 Y2 Er2 Tm2 Ni2 Te2",
"formula_reduced": "DyY2Er2Tm2(NiTe)2",
"formula_anonymous": "AB2C2D2E2F2",
"formation_energy": -0.6823602493939389,
"spacegroup": 44
},
{
"id": "oqmd-1527238",
"created_at": "2022-09-04T15:54:39.812452Z",
"updated_at": "2022-09-04T15:54:39.812482Z",
"structure_string": "Y1 Er2 Tm2 Lu2 Ni2 Te2\n1.0\n-1.906865 7.694966 4.721370\n1.906865 -7.694966 4.721370\n1.906865 7.694966 -4.721370\nEr Lu Ni Te Tm Y\n2 2 2 2 2 1\ndirect\n0.412418 0.097742 0.314676 Er\n0.783066 0.097742 0.685324 Er\n0.027773 0.894745 0.133028 Lu\n0.761716 0.894745 0.866972 Lu\n0.643753 0.404784 0.238969 Ni\n0.165815 0.404784 0.761031 Ni\n0.139215 0.139215 0.000000 Te\n0.743663 0.243663 0.500000 Te\n0.098477 0.745924 0.352553 Tm\n0.393371 0.745924 0.647447 Tm\n0.476854 0.476854 0.000000 Y\n",
"nsites": 11,
"nelements": 6,
"elements": [
"Er",
"Lu",
"Ni",
"Te",
"Tm",
"Y"
],
"chemical_system": "Er-Lu-Ni-Te-Tm-Y",
"density": 8.891470858941348,
"density_atomic": 0.03969520096216422,
"volume": 277.11158360137114,
"volume_molar": 15.170954206126952,
"formula_full": "Y1 Er2 Tm2 Lu2 Ni2 Te2",
"formula_reduced": "YEr2Tm2Lu2(NiTe)2",
"formula_anonymous": "AB2C2D2E2F2",
"formation_energy": -0.6840108628787867,
"spacegroup": 44
}
]
}