HTTP 200 OK
Allow: GET, HEAD, OPTIONS
Content-Type: application/json
Vary: Accept
{
"count": 55712,
"next": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4343",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=4341",
"results": [
{
"id": "jvasp-112360",
"created_at": "2022-09-04T14:38:26.617275Z",
"updated_at": "2022-09-04T14:38:26.617299Z",
"structure_string": "Li4 Al2 Cr4 Sb2 O16\n1.0\n5.847101 -0.005946 0.026503\n2.956406 5.044630 0.026503\n-0.006831 -0.003910 9.542702\nLi Al Cr Sb O\n4 2 4 2 16\ndirect\n0.334201 0.334200 0.598241 Li\n0.665572 0.665571 0.093147 Li\n0.001577 0.001577 0.007031 Li\n0.998243 0.998241 0.513575 Li\n0.340277 0.830141 0.785678 Al\n0.830142 0.340276 0.785678 Al\n0.168479 0.660600 0.285981 Cr\n0.830068 0.830066 0.785808 Cr\n0.168800 0.168800 0.285630 Cr\n0.660601 0.168478 0.285981 Cr\n0.333970 0.333970 0.009397 Sb\n0.664786 0.664785 0.514175 Sb\n0.331747 0.331747 0.392761 O\n0.517061 0.517060 0.662728 O\n0.484764 0.032099 0.158577 O\n0.032100 0.484763 0.158577 O\n0.483095 0.483095 0.159431 O\n0.659831 0.659830 0.887234 O\n0.836470 0.323559 0.404998 O\n0.008099 0.008099 0.700531 O\n0.836529 0.836528 0.405963 O\n0.169691 0.676594 0.900275 O\n0.676594 0.169690 0.900275 O\n0.165122 0.165121 0.898323 O\n0.965479 0.513107 0.661723 O\n0.000046 0.000046 0.190949 O\n0.323560 0.836469 0.404998 O\n0.513108 0.965477 0.661723 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"Al",
"Cr",
"Sb",
"O"
],
"chemical_system": "Al-Cr-Li-O-Sb",
"density": 4.653142137412998,
"density_atomic": 0.09941596614539702,
"volume": 281.644901574961,
"volume_molar": 6.057518720074147,
"formula_full": "Li4 Al2 Cr4 Sb2 O16",
"formula_reduced": "Li2AlCr2SbO8",
"formula_anonymous": "ABC2D2E8",
"energy_above_hull": 2.797474407142857,
"spacegroup": 8
},
{
"id": "jvasp-117382",
"created_at": "2022-09-04T14:38:27.167850Z",
"updated_at": "2022-09-04T14:38:27.167875Z",
"structure_string": "K3 Ti8 O17\n1.0\n8.008351 -0.022176 0.704574\n7.099913 3.704783 0.704574\n-0.028765 -0.007011 12.115461\nK Ti O\n3 8 17\ndirect\n0.557931 0.557929 0.164233 K\n0.442625 0.442624 0.820869 K\n0.510830 0.510828 0.455178 K\n0.199029 0.199028 0.423419 Ti\n0.804067 0.804065 0.578953 Ti\n0.887809 0.887806 0.070232 Ti\n0.111086 0.111086 0.928626 Ti\n0.755877 0.755875 0.830653 Ti\n0.150309 0.150309 0.674325 Ti\n0.848978 0.848975 0.324567 Ti\n0.243138 0.243137 0.170749 Ti\n0.105962 0.105962 0.535174 O\n0.227745 0.227745 0.816127 O\n0.772054 0.772052 0.185805 O\n0.148630 0.148629 0.293042 O\n0.850266 0.850263 0.710908 O\n-0.000159 -0.000159 0.000668 O\n0.894053 0.894050 0.464884 O\n0.725640 0.725638 0.433602 O\n0.684727 0.684725 0.675928 O\n0.364882 0.364881 0.090405 O\n0.635103 0.635101 0.913307 O\n0.274212 0.274211 0.568241 O\n0.940415 0.940412 0.226965 O\n0.172370 0.172370 0.063228 O\n0.827700 0.827698 0.938143 O\n0.316044 0.316043 0.325741 O\n0.061598 0.061598 0.777040 O\n",
"nsites": 28,
"nelements": 3,
"elements": [
"K",
"Ti",
"O"
],
"chemical_system": "K-O-Ti",
"density": 3.547725000997848,
"density_atomic": 0.07746712585567521,
"volume": 361.44364065042606,
"volume_molar": 7.7738017171561555,
"formula_full": "K3 Ti8 O17",
"formula_reduced": "K3Ti8O17",
"formula_anonymous": "A3B8C17",
"energy_above_hull": 3.043490005952381,
"spacegroup": 8
},
{
"id": "jvasp-117319",
"created_at": "2022-09-04T14:38:26.604712Z",
"updated_at": "2022-09-04T14:38:26.604733Z",
"structure_string": "Li4 V3 Cr3 Fe2 O16\n1.0\n5.729414 -0.000516 0.018714\n-2.848486 4.970661 -0.037331\n-0.000828 0.036475 9.284559\nLi V Cr Fe O\n4 3 3 2 16\ndirect\n0.331846 0.668164 0.108679 Li\n-0.001849 0.001847 0.004236 Li\n0.002027 0.997801 0.504556 Li\n0.665050 0.335047 0.612974 Li\n0.824097 0.651695 0.288050 V\n0.173017 0.827088 0.788648 V\n0.348248 0.175882 0.288076 V\n0.168425 0.343097 0.787997 Cr\n0.828656 0.171302 0.289118 Cr\n0.656989 0.831650 0.787993 Cr\n0.333897 0.666118 0.514571 Fe\n0.667098 0.332938 0.011414 Fe\n0.829674 0.170376 0.899317 O\n0.835424 0.661763 0.896301 O\n0.666167 0.333771 0.407521 O\n0.521346 0.045259 0.155417 O\n0.954750 0.478661 0.155398 O\n0.171199 0.828772 0.394121 O\n0.043065 0.525454 0.653437 O\n0.476755 0.523330 0.657637 O\n0.176869 0.338310 0.397984 O\n0.001639 0.998366 0.193078 O\n0.000867 0.999254 0.692678 O\n0.330113 0.669951 0.903982 O\n0.520322 0.479715 0.151285 O\n0.661646 0.823067 0.397972 O\n0.474628 0.956992 0.653417 O\n0.338310 0.164646 0.896303 O\n",
"nsites": 28,
"nelements": 5,
"elements": [
"Li",
"V",
"Cr",
"Fe",
"O"
],
"chemical_system": "Cr-Fe-Li-O-V",
"density": 4.4229031596329245,
"density_atomic": 0.10589734422625131,
"volume": 264.4070085476135,
"volume_molar": 5.686772226443757,
"formula_full": "Li4 V3 Cr3 Fe2 O16",
"formula_reduced": "Li4V3Cr3(FeO8)2",
"formula_anonymous": "A2B3C3D4E16",
"energy_above_hull": 3.3898164928571424,
"spacegroup": 8
},
{
"id": "jvasp-117371",
"created_at": "2022-09-04T14:38:27.103793Z",
"updated_at": "2022-09-04T14:38:27.103826Z",
"structure_string": "Sm2 Ga2 Fe15 C2\n1.0\n6.398149 -0.012205 0.802546\n0.678717 6.362060 0.802546\n-0.004556 -0.004088 6.532044\nSm Ga Fe C\n2 2 15 2\ndirect\n0.343683 0.343682 0.323446 Sm\n0.653266 0.653265 0.671006 Sm\n0.336649 0.837685 0.337466 Ga\n0.837685 0.336648 0.337466 Ga\n0.343767 0.343767 0.854671 Fe\n0.152830 0.658537 0.667833 Fe\n0.658537 0.152830 0.667833 Fe\n0.663366 0.663365 0.131814 Fe\n0.995131 0.995130 0.510911 Fe\n0.496859 0.003079 0.999573 Fe\n0.003080 0.496859 0.999573 Fe\n0.276914 0.722636 0.993494 Fe\n0.005557 0.288671 0.710490 Fe\n0.722636 0.276913 0.993494 Fe\n0.990365 0.709150 0.285755 Fe\n0.288671 0.005557 0.710490 Fe\n0.902381 0.902380 0.906820 Fe\n0.092970 0.092970 0.091011 Fe\n0.709151 0.990364 0.285755 Fe\n0.512618 0.013884 0.510554 C\n0.013885 0.512618 0.510554 C\n",
"nsites": 21,
"nelements": 4,
"elements": [
"Sm",
"Ga",
"Fe",
"C"
],
"chemical_system": "C-Fe-Ga-Sm",
"density": 8.12747981382057,
"density_atomic": 0.07895161401664319,
"volume": 265.985695942494,
"volume_molar": 7.627634767201236,
"formula_full": "Sm2 Ga2 Fe15 C2",
"formula_reduced": "Sm2Ga2Fe15C2",
"formula_anonymous": "A2B2C2D15",
"energy_above_hull": 3.965090709523809,
"spacegroup": 8
},
{
"id": "jvasp-9266",
"created_at": "2022-09-04T14:38:28.623346Z",
"updated_at": "2022-09-04T14:38:28.623368Z",
"structure_string": "Mg1 Mo4 O8\n1.0\n2.797382 -0.007465 -0.008666\n-1.378272 7.414375 0.189789\n-1.377138 -0.750903 7.559524\nMg Mo O\n1 4 8\ndirect\n0.449251 0.103786 0.806729 Mg\n0.808446 0.194888 0.433980 Mo\n0.653955 0.486895 0.833021 Mo\n0.307748 0.506364 0.121103 Mo\n0.143742 0.789371 0.510080 Mo\n0.504275 0.665508 0.355013 O\n0.793423 0.348103 0.250750 O\n0.165742 0.639241 0.704171 O\n0.446792 0.299711 0.605880 O\n0.178419 0.006987 0.361793 O\n0.095838 0.285986 0.917697 O\n0.811861 0.978697 0.657013 O\n0.853548 0.685101 0.033973 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Mg",
"Mo",
"O"
],
"chemical_system": "Mg-Mo-O",
"density": 5.669151333996158,
"density_atomic": 0.0827939763767657,
"volume": 157.0162537047582,
"volume_molar": 7.273646010907118,
"formula_full": "Mg1 Mo4 O8",
"formula_reduced": "Mg(MoO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 3.850408511538462,
"spacegroup": 8
},
{
"id": "jvasp-119752",
"created_at": "2022-09-04T14:38:27.608457Z",
"updated_at": "2022-09-04T14:38:27.608483Z",
"structure_string": "Co6 O8 F4\n1.0\n4.956212 -0.028685 1.802028\n1.366971 4.764058 1.802028\n-0.109257 -0.081821 7.058313\nCo O F\n6 8 4\ndirect\n0.673525 0.673526 0.846376 Co\n0.657315 0.657316 0.317673 Co\n0.338635 0.338636 0.652218 Co\n0.338172 0.338173 0.177346 Co\n0.997316 0.997316 0.497366 Co\n0.989752 0.989752 0.997791 Co\n0.302574 0.696406 0.002313 O\n0.696406 0.302573 0.002313 O\n0.034392 0.638888 0.668819 O\n0.361971 0.969453 0.334244 O\n0.435519 0.435520 0.366304 O\n0.638887 0.034392 0.668819 O\n0.969452 0.361971 0.334244 O\n0.765202 0.765202 0.037929 O\n0.231843 0.231844 0.964325 F\n0.577144 0.577144 0.632198 F\n0.893907 0.893907 0.308070 F\n0.097979 0.097980 0.691658 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.49792975452122,
"density_atomic": 0.10688313634002089,
"volume": 168.40823179755583,
"volume_molar": 5.634322650153273,
"formula_full": "Co6 O8 F4",
"formula_reduced": "Co3(O2F)2",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 2.3732952516666663,
"spacegroup": 8
},
{
"id": "jvasp-117440",
"created_at": "2022-09-04T14:38:27.505962Z",
"updated_at": "2022-09-04T14:38:27.505987Z",
"structure_string": "V8 O8 F8\n1.0\n7.691798 0.030182 0.020392\n-2.071423 7.407690 0.020392\n-0.004800 -0.006352 4.623363\nV O F\n8 8 8\ndirect\n0.615280 0.615279 0.566976 V\n0.361219 0.862713 0.476032 V\n0.142326 0.142326 0.446249 V\n0.862713 0.361218 0.476032 V\n0.514877 0.246356 0.011087 V\n0.766622 0.994038 0.012295 V\n0.246356 0.514877 0.011087 V\n0.994038 0.766621 0.012295 V\n0.772947 0.772946 0.805867 O\n0.395686 0.650620 0.700212 O\n0.650620 0.395685 0.700212 O\n0.098985 0.353439 0.295778 O\n0.353439 0.098985 0.295778 O\n0.209839 0.725498 0.193385 O\n0.725498 0.209838 0.193385 O\n0.981448 0.981447 0.208426 O\n0.475963 0.475963 0.207662 F\n0.596122 0.836725 0.297774 F\n0.836725 0.596121 0.297774 F\n0.913605 0.153326 0.703911 F\n0.153326 0.913605 0.703911 F\n0.018791 0.534272 0.791950 F\n0.534271 0.018790 0.791950 F\n0.279312 0.279312 0.799957 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.328951386701667,
"density_atomic": 0.09100453563925467,
"volume": 263.7231191985516,
"volume_molar": 6.617407272833068,
"formula_full": "V8 O8 F8",
"formula_reduced": "VOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.0557226608333332,
"spacegroup": 8
},
{
"id": "jvasp-119753",
"created_at": "2022-09-04T14:38:27.656097Z",
"updated_at": "2022-09-04T14:38:27.656108Z",
"structure_string": "Mn6 O10 F2\n1.0\n5.083890 -0.018551 1.728808\n1.257019 4.926073 1.728808\n0.006822 0.005280 7.110268\nMn O F\n6 10 2\ndirect\n0.326139 0.326139 0.155344 Mn\n0.673402 0.673402 0.332531 Mn\n0.345105 0.345105 0.681273 Mn\n0.669280 0.669280 0.837476 Mn\n0.995888 0.995888 0.491738 Mn\n0.994016 0.994016 0.009649 Mn\n0.302519 0.692643 -0.000599 O\n0.692643 0.302519 -0.000599 O\n0.361278 0.971019 0.332674 O\n0.032045 0.638007 0.666045 O\n0.570160 0.570160 0.627599 O\n0.767524 0.767523 0.038905 O\n0.897186 0.897185 0.296622 O\n0.638007 0.032045 0.666045 O\n0.971019 0.361278 0.332674 O\n0.227503 0.227503 0.965862 O\n0.103877 0.103877 0.700501 F\n0.432409 0.432409 0.366267 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Mn",
"O",
"F"
],
"chemical_system": "F-Mn-O",
"density": 4.918239861921392,
"density_atomic": 0.10104448708349295,
"volume": 178.13935742111906,
"volume_molar": 5.959890473810719,
"formula_full": "Mn6 O10 F2",
"formula_reduced": "Mn3O5F",
"formula_anonymous": "AB3C5",
"energy_above_hull": 3.0232043896264367,
"spacegroup": 8
},
{
"id": "jvasp-109353",
"created_at": "2022-09-04T14:38:28.293681Z",
"updated_at": "2022-09-04T14:38:28.293707Z",
"structure_string": "V1 Fe2 S4\n1.0\n5.534974 -0.037604 2.497771\n4.600205 3.078226 2.497771\n-0.002875 -0.000863 5.673589\nV Fe S\n1 2 4\ndirect\n0.261808 0.261812 0.683807 V\n0.011976 0.011979 0.997762 Fe\n0.732733 0.732739 0.317325 Fe\n0.633518 0.633522 0.028333 S\n0.360300 0.360305 0.990333 S\n0.105497 0.105499 0.553438 S\n0.894150 0.894157 0.429005 S\n",
"nsites": 7,
"nelements": 3,
"elements": [
"V",
"Fe",
"S"
],
"chemical_system": "Fe-S-V",
"density": 4.945503811992725,
"density_atomic": 0.07166852268512583,
"volume": 97.67188910470996,
"volume_molar": 8.40276949262391,
"formula_full": "V1 Fe2 S4",
"formula_reduced": "V(FeS2)2",
"formula_anonymous": "AB2C4",
"energy_above_hull": 2.959746457142857,
"spacegroup": 8
},
{
"id": "jvasp-10737",
"created_at": "2022-09-04T14:38:28.683550Z",
"updated_at": "2022-09-04T14:38:28.683574Z",
"structure_string": "Ca1 Sn4 O8\n1.0\n3.285210 0.000312 0.000254\n1.642322 7.656009 -0.005392\n1.642559 1.623282 7.867106\nCa Sn O\n1 4 8\ndirect\n0.643126 0.895779 0.818091 Ca\n0.369403 0.829393 0.432069 Sn\n0.892213 0.428304 0.787187 Sn\n0.149877 0.544118 0.156326 Sn\n0.665359 0.194448 0.474926 Sn\n0.125527 0.353950 0.395077 O\n0.534861 0.672102 0.258331 O\n0.515788 0.246877 0.721459 O\n0.856836 0.710663 0.575923 O\n0.837822 0.003014 0.321590 O\n0.165747 0.728924 0.939688 O\n0.194611 0.016408 0.594466 O\n0.753065 0.399908 0.094223 O\n",
"nsites": 13,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"O"
],
"chemical_system": "Ca-O-Sn",
"density": 5.394760089877031,
"density_atomic": 0.06569223657340674,
"volume": 197.89248590239973,
"volume_molar": 9.167203118850516,
"formula_full": "Ca1 Sn4 O8",
"formula_reduced": "Ca(SnO2)4",
"formula_anonymous": "AB4C8",
"energy_above_hull": 1.803827928205128,
"spacegroup": 8
},
{
"id": "jvasp-118785",
"created_at": "2022-09-04T14:38:28.970075Z",
"updated_at": "2022-09-04T14:38:28.970104Z",
"structure_string": "Na3 F1\n1.0\n3.274057 -0.449778 -0.312668\n-0.621272 -5.447817 1.933260\n1.122802 0.602126 -5.756080\nNa F\n3 1\ndirect\n0.220595 0.069882 0.948516 Na\n0.582885 0.688319 0.248008 Na\n0.938910 0.369122 0.552063 Na\n0.582650 0.296726 0.246656 F\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"F"
],
"chemical_system": "F-Na",
"density": 1.4952263505063947,
"density_atomic": 0.04094440311094564,
"volume": 97.69345004642851,
"volume_molar": 14.708092687740526,
"formula_full": "Na3 F1",
"formula_reduced": "Na3F",
"formula_anonymous": "AB3",
"energy_above_hull": 0.0,
"spacegroup": 8
},
{
"id": "jvasp-118796",
"created_at": "2022-09-04T14:38:29.108522Z",
"updated_at": "2022-09-04T14:38:29.108542Z",
"structure_string": "Na2 Se2\n1.0\n4.622529 -0.505935 -0.482710\n1.937151 -4.260159 -0.006655\n-0.433480 -0.405433 -5.503626\nNa Se\n2 2\ndirect\n0.887826 0.180739 0.059985 Na\n0.571946 0.864849 0.564868 Na\n0.210020 0.501301 0.801822 Se\n0.260581 0.553660 0.344454 Se\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Na",
"Se"
],
"chemical_system": "Na-Se",
"density": 3.247988516694085,
"density_atomic": 0.038371531744097846,
"volume": 104.24394904733674,
"volume_molar": 15.694293363533243,
"formula_full": "Na2 Se2",
"formula_reduced": "NaSe",
"formula_anonymous": "AB",
"energy_above_hull": 0.0747408416666667,
"spacegroup": 8
}
]
}