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=formula_anonymous&page=389",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=387",
"results": [
{
"id": "jvasp-85210",
"created_at": "2022-09-04T14:37:06.002154Z",
"updated_at": "2022-09-04T14:37:06.002177Z",
"structure_string": "Ba7 Al10\n1.0\n5.978383 -0.004006 15.612464\n2.883703 5.236921 15.612464\n-0.006786 -0.004006 16.717956\nBa Al\n7 10\ndirect\n0.359499 0.359499 0.359500 Ba\n0.051930 0.051930 0.051930 Ba\n0.948069 0.948068 0.948072 Ba\n0.129076 0.129076 0.129077 Ba\n0.870923 0.870922 0.870925 Ba\n0.640500 0.640500 0.640502 Ba\n0.500000 0.499999 0.500001 Ba\n0.284153 0.284153 0.284154 Al\n0.200929 0.200929 0.200930 Al\n0.888438 0.418904 0.418906 Al\n0.111561 0.581095 0.581096 Al\n0.581095 0.111561 0.581096 Al\n0.799070 0.799070 0.799072 Al\n0.418904 0.888437 0.418906 Al\n0.581095 0.581095 0.111563 Al\n0.715846 0.715846 0.715848 Al\n0.418904 0.418904 0.888440 Al\n",
"nsites": 17,
"nelements": 2,
"elements": [
"Ba",
"Al"
],
"chemical_system": "Al-Ba",
"density": 3.8987032741620165,
"density_atomic": 0.03242090459192253,
"volume": 524.3530436296169,
"volume_molar": 18.574869627482197,
"formula_full": "Ba7 Al10",
"formula_reduced": "Ba7Al10",
"formula_anonymous": "A7B10",
"energy_above_hull": 1.0991917523529413,
"spacegroup": 166
},
{
"id": "jvasp-52127",
"created_at": "2022-09-04T14:37:01.429477Z",
"updated_at": "2022-09-04T14:37:01.429505Z",
"structure_string": "Nb10 C7\n1.0\n6.356194 -0.004245 -0.003001\n7.935796 13.744925 0.056028\n3.174318 3.675878 2.599239\nNb C\n10 7\ndirect\n0.017384 0.207909 0.956354 Nb\n0.991042 0.804619 0.996406 Nb\n0.508957 0.395381 0.003595 Nb\n0.986692 0.600000 0.026567 Nb\n0.482616 0.207909 0.004102 Nb\n0.991042 0.395381 0.019500 Nb\n0.482617 0.992091 0.043648 Nb\n0.513308 0.600000 0.973435 Nb\n0.508958 0.804619 0.980501 Nb\n0.017385 0.992090 0.995899 Nb\n0.750000 0.801364 0.496590 C\n0.750000 0.600000 0.500001 C\n0.250001 0.802362 0.494095 C\n0.750000 0.398635 0.503412 C\n0.250000 0.397637 0.505906 C\n0.250000 0.200540 0.498651 C\n0.250001 0.999460 0.501350 C\n",
"nsites": 17,
"nelements": 2,
"elements": [
"Nb",
"C"
],
"chemical_system": "C-Nb",
"density": 7.4471948607220915,
"density_atomic": 0.07525296856951222,
"volume": 225.90470945072238,
"volume_molar": 8.002529168583251,
"formula_full": "Nb10 C7",
"formula_reduced": "Nb10C7",
"formula_anonymous": "A7B10",
"energy_above_hull": 7.130631411764705,
"spacegroup": 12
},
{
"id": "jvasp-34187",
"created_at": "2022-09-04T14:37:08.961753Z",
"updated_at": "2022-09-04T14:37:08.961771Z",
"structure_string": "Nb10 C7\n1.0\n6.356194 -0.004245 -0.003001\n7.935796 13.744925 0.056028\n3.174318 3.675878 2.599239\nNb C\n10 7\ndirect\n0.017384 0.207909 0.956354 Nb\n0.991042 0.804619 0.996406 Nb\n0.508957 0.395381 0.003595 Nb\n0.986692 0.600000 0.026567 Nb\n0.482616 0.207909 0.004102 Nb\n0.991042 0.395381 0.019500 Nb\n0.482617 0.992091 0.043648 Nb\n0.513308 0.600000 0.973435 Nb\n0.508958 0.804619 0.980501 Nb\n0.017385 0.992090 0.995899 Nb\n0.750000 0.801364 0.496590 C\n0.750000 0.600000 0.500001 C\n0.250001 0.802362 0.494095 C\n0.750000 0.398635 0.503412 C\n0.250000 0.397637 0.505906 C\n0.250000 0.200540 0.498651 C\n0.250001 0.999460 0.501350 C\n",
"nsites": 17,
"nelements": 2,
"elements": [
"Nb",
"C"
],
"chemical_system": "C-Nb",
"density": 7.4471948607220915,
"density_atomic": 0.07525296856951222,
"volume": 225.90470945072238,
"volume_molar": 8.002529168583251,
"formula_full": "Nb10 C7",
"formula_reduced": "Nb10C7",
"formula_anonymous": "A7B10",
"energy_above_hull": 7.130631411764705,
"spacegroup": 12
},
{
"id": "jvasp-112127",
"created_at": "2022-09-04T14:38:44.816631Z",
"updated_at": "2022-09-04T14:38:44.816658Z",
"structure_string": "H44 C28\n1.0\n6.182852 -0.017490 0.000000\n-0.974284 9.436984 -0.000002\n0.000000 -0.000002 9.783932\nH C\n44 28\ndirect\n0.729423 0.159316 0.429774 H\n0.097016 0.454073 0.277325 H\n0.902985 0.545927 0.722674 H\n0.402984 0.045927 0.777325 H\n0.597016 0.954072 0.222674 H\n0.129853 0.398552 0.449087 H\n0.870147 0.601448 0.550913 H\n0.370147 0.101449 0.949086 H\n0.629853 0.898551 0.050914 H\n0.033381 0.085566 0.123995 H\n0.966619 0.914434 0.876005 H\n0.466620 0.414433 0.623995 H\n0.035101 0.269557 0.085885 H\n0.964900 0.730442 0.914114 H\n0.464900 0.230443 0.585886 H\n0.535101 0.769558 0.414115 H\n0.814314 0.179752 0.178732 H\n0.185688 0.820248 0.821268 H\n0.685686 0.320248 0.678732 H\n0.314312 0.679752 0.321267 H\n0.372017 0.866312 0.132833 H\n0.627984 0.133687 0.867167 H\n0.533381 0.585565 0.376005 H\n0.872016 0.366313 0.367167 H\n0.127984 0.633687 0.632833 H\n0.270577 0.840684 0.570226 H\n0.770578 0.340684 0.929773 H\n0.229425 0.659315 0.070226 H\n0.372007 0.026497 0.403896 H\n0.127994 0.473503 0.903896 H\n0.872008 0.526496 0.096104 H\n0.456865 0.278058 0.356630 H\n0.543136 0.721942 0.643370 H\n0.627993 0.973504 0.596104 H\n0.956865 0.778058 0.143370 H\n0.392089 0.336015 0.190690 H\n0.607912 0.663986 0.809310 H\n0.107912 0.163986 0.690690 H\n0.892088 0.836014 0.309310 H\n0.417498 0.154219 0.219054 H\n0.582503 0.845782 0.780946 H\n0.082502 0.345782 0.719054 H\n0.043135 0.221942 0.856630 H\n0.917498 0.654218 0.280946 H\n0.615663 0.727597 0.202575 C\n0.360054 0.249425 0.264527 C\n0.639944 0.750575 0.735473 C\n0.139946 0.250576 0.764527 C\n0.860056 0.749424 0.235473 C\n0.548550 0.869671 0.148487 C\n0.951451 0.630327 0.648487 C\n0.451450 0.130327 0.851513 C\n0.991232 0.187879 0.163544 C\n0.384338 0.272404 0.797425 C\n0.008770 0.812121 0.836457 C\n0.048550 0.369672 0.351513 C\n0.884338 0.772402 0.702576 C\n0.559501 0.610086 0.097302 C\n0.707848 0.517173 0.054603 C\n0.292151 0.482826 0.945398 C\n0.792152 0.982827 0.554603 C\n0.207849 0.017174 0.445397 C\n0.350484 0.589668 0.040529 C\n0.649515 0.410331 0.959472 C\n0.149517 0.910332 0.540528 C\n0.850484 0.089669 0.459472 C\n0.440499 0.389917 0.902696 C\n0.940499 0.889915 0.597303 C\n0.059501 0.110084 0.402697 C\n0.508769 0.312121 0.663544 C\n0.115662 0.227596 0.297426 C\n0.491231 0.687878 0.336457 C\n",
"nsites": 72,
"nelements": 2,
"elements": [
"H",
"C"
],
"chemical_system": "C-H",
"density": 1.1075544922571992,
"density_atomic": 0.1261606315413199,
"volume": 570.7010112454826,
"volume_molar": 4.7733914188814435,
"formula_full": "H44 C28",
"formula_reduced": "H11C7",
"formula_anonymous": "A7B11",
"energy_above_hull": 4.919318888888889,
"spacegroup": 14
},
{
"id": "jvasp-52603",
"created_at": "2022-09-04T14:37:05.511898Z",
"updated_at": "2022-09-04T14:37:05.511930Z",
"structure_string": "V12 P7\n1.0\n4.673009 -8.093889 -0.000000\n4.673009 8.093889 -0.000000\n0.000000 -0.000000 3.236150\nV P\n12 7\ndirect\n0.198024 0.202501 0.500000 V\n0.747631 0.735123 0.000000 V\n0.869505 0.496598 0.000000 V\n0.503402 0.372907 0.000000 V\n0.627093 0.130495 0.000000 V\n0.797499 0.995524 0.500000 V\n0.987491 0.252369 0.000000 V\n0.264877 0.012509 0.000000 V\n0.489816 0.622634 0.500000 V\n0.004476 0.801976 0.500000 V\n0.132817 0.510184 0.500000 V\n0.377367 0.867183 0.500000 V\n0.829866 0.291651 0.500000 P\n0.285227 0.441798 0.000000 P\n0.156570 0.714773 0.000000 P\n0.558202 0.843430 0.000000 P\n0.461785 0.170134 0.500000 P\n0.000000 0.000000 0.000000 P\n0.708349 0.538215 0.500000 P\n",
"nsites": 19,
"nelements": 2,
"elements": [
"V",
"P"
],
"chemical_system": "P-V",
"density": 5.617290687466562,
"density_atomic": 0.07761418475912656,
"volume": 244.80061291587313,
"volume_molar": 7.759072363756116,
"formula_full": "V12 P7",
"formula_reduced": "V12P7",
"formula_anonymous": "A7B12",
"energy_above_hull": 4.811454678947368,
"spacegroup": 174
},
{
"id": "jvasp-12405",
"created_at": "2022-09-04T14:37:05.320316Z",
"updated_at": "2022-09-04T14:37:05.320337Z",
"structure_string": "Tb7 O12\n1.0\n6.534622 -0.015295 -1.087743\n-1.281306 6.407790 -1.087743\n-0.012569 -0.015294 6.624523\nTb O\n7 12\ndirect\n0.000000 0.000000 0.000000 Tb\n0.301380 0.138605 0.608305 Tb\n0.608305 0.301381 0.138604 Tb\n0.861395 0.391696 0.698620 Tb\n0.698619 0.861397 0.391695 Tb\n0.391694 0.698621 0.861396 Tb\n0.138604 0.608305 0.301380 Tb\n0.062936 0.935426 0.326041 O\n0.935426 0.326041 0.062937 O\n0.179063 0.436028 0.578467 O\n0.064573 0.673960 0.937064 O\n0.326041 0.062937 0.935426 O\n0.421532 0.820937 0.563972 O\n0.563972 0.421534 0.820937 O\n0.820936 0.563973 0.421533 O\n0.578467 0.179064 0.436028 O\n0.436027 0.578468 0.179064 O\n0.937064 0.064575 0.673960 O\n0.673959 0.937064 0.064574 O\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Tb",
"O"
],
"chemical_system": "O-Tb",
"density": 7.81888084310007,
"density_atomic": 0.06858275378397283,
"volume": 277.0375779871372,
"volume_molar": 8.78083837077904,
"formula_full": "Tb7 O12",
"formula_reduced": "Tb7O12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.403853726315789,
"spacegroup": 148
},
{
"id": "jvasp-85878",
"created_at": "2022-09-04T14:36:04.091866Z",
"updated_at": "2022-09-04T14:36:04.091890Z",
"structure_string": "Ce7 O12\n1.0\n6.678731 -0.017630 -1.117931\n-1.317754 6.547463 -1.117932\n-0.014474 -0.017630 6.771633\nCe O\n7 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.138831 0.600918 0.299499 Ce\n0.299499 0.138830 0.600919 Ce\n0.399082 0.700501 0.861170 Ce\n0.861170 0.399081 0.700501 Ce\n0.700502 0.861169 0.399082 Ce\n0.600919 0.299499 0.138830 Ce\n0.566221 0.417884 0.822314 O\n0.417885 0.822314 0.566221 O\n0.932100 0.072303 0.678393 O\n0.582116 0.177686 0.433780 O\n0.822315 0.566220 0.417885 O\n0.321607 0.067900 0.927697 O\n0.927697 0.321607 0.067901 O\n0.067901 0.927697 0.321607 O\n0.678394 0.932099 0.072303 O\n0.072304 0.678393 0.932100 O\n0.433780 0.582115 0.177686 O\n0.177686 0.433779 0.582115 O\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 6.586163884083425,
"density_atomic": 0.06425564713323319,
"volume": 295.6938549012473,
"volume_molar": 9.372157979380669,
"formula_full": "Ce7 O12",
"formula_reduced": "Ce7O12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.7546593421052634,
"spacegroup": 148
},
{
"id": "jvasp-22422",
"created_at": "2022-09-04T14:38:29.713551Z",
"updated_at": "2022-09-04T14:38:29.713577Z",
"structure_string": "Th7 Te12\n1.0\n6.295001 -10.903260 -0.000000\n6.295000 10.903260 0.000000\n0.000000 -0.000000 4.367984\nTh Te\n7 12\ndirect\n0.560700 0.723065 0.000000 Th\n0.276935 0.837635 0.000000 Th\n0.162365 0.439300 0.000000 Th\n0.835265 0.547412 0.500000 Th\n0.452588 0.287852 0.500000 Th\n0.712148 0.164735 0.500000 Th\n0.000000 0.000000 0.000000 Th\n0.782090 0.786284 0.500000 Te\n0.213716 0.995807 0.500000 Te\n0.004193 0.217909 0.500000 Te\n0.478179 0.864609 0.500000 Te\n0.868083 0.375826 0.000000 Te\n0.752844 0.008513 0.000000 Te\n0.624174 0.492257 0.000000 Te\n0.386429 0.521821 0.500000 Te\n0.255668 0.247156 0.000000 Te\n0.991487 0.744332 0.000000 Te\n0.507743 0.131917 0.000000 Te\n0.135391 0.613571 0.500000 Te\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Th",
"Te"
],
"chemical_system": "Te-Th",
"density": 8.738753486330037,
"density_atomic": 0.0316876789332566,
"volume": 599.6021368437708,
"volume_molar": 19.004676147736685,
"formula_full": "Th7 Te12",
"formula_reduced": "Th7Te12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.2281206526315795,
"spacegroup": 174
},
{
"id": "jvasp-12306",
"created_at": "2022-09-04T14:37:26.904657Z",
"updated_at": "2022-09-04T14:37:26.904684Z",
"structure_string": "U7 Te12\n1.0\n6.217214 -10.768531 0.000000\n6.217214 10.768530 0.000000\n0.000000 0.000000 4.200920\nU Te\n7 12\ndirect\n0.844887 0.567692 0.000000 U\n0.432307 0.277194 0.000000 U\n0.722805 0.155112 0.000000 U\n0.291004 0.839819 0.500000 U\n0.160181 0.451185 0.500000 U\n0.548815 0.708995 0.500000 U\n0.000000 0.000000 0.000000 U\n0.996987 0.785810 0.500000 Te\n0.214190 0.211176 0.500000 Te\n0.788824 0.003012 0.500000 Te\n0.614812 0.475775 0.500000 Te\n0.491472 0.863886 0.000000 Te\n0.744197 0.751888 0.000000 Te\n0.136113 0.627586 0.000000 Te\n0.860962 0.385187 0.500000 Te\n0.007691 0.255802 0.000000 Te\n0.248111 0.992309 0.000000 Te\n0.372413 0.508527 0.000000 Te\n0.524224 0.139037 0.500000 Te\n",
"nsites": 19,
"nelements": 2,
"elements": [
"U",
"Te"
],
"chemical_system": "Te-U",
"density": 9.438863909731598,
"density_atomic": 0.033777455881228054,
"volume": 562.5053605816215,
"volume_molar": 17.82887610356358,
"formula_full": "U7 Te12",
"formula_reduced": "U7Te12",
"formula_anonymous": "A7B12",
"energy_above_hull": 3.4652623789473687,
"spacegroup": 174
},
{
"id": "jvasp-34767",
"created_at": "2022-09-04T14:38:32.303525Z",
"updated_at": "2022-09-04T14:38:32.303536Z",
"structure_string": "Sc7 Cl12\n1.0\n7.686825 -0.001858 -2.411273\n-3.283013 6.950476 -2.411272\n-0.001176 -0.001858 8.056148\nSc Cl\n7 12\ndirect\n0.312306 0.031217 0.104978 Sc\n0.031217 0.104977 0.312306 Sc\n0.687694 0.968783 0.895023 Sc\n0.895023 0.687693 0.968783 Sc\n0.968783 0.895022 0.687695 Sc\n0.500000 0.500000 0.500000 Sc\n0.104978 0.312306 0.031218 Sc\n0.225606 0.684516 0.075988 Cl\n0.684516 0.075987 0.225606 Cl\n0.613193 0.844873 0.533348 Cl\n0.315484 0.924013 0.774395 Cl\n0.075987 0.225606 0.684516 Cl\n0.466653 0.386807 0.155127 Cl\n0.155127 0.466653 0.386808 Cl\n0.386807 0.155127 0.466653 Cl\n0.533347 0.613193 0.844874 Cl\n0.844873 0.533347 0.613193 Cl\n0.774394 0.315484 0.924013 Cl\n0.924014 0.774394 0.315485 Cl\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Sc",
"Cl"
],
"chemical_system": "Cl-Sc",
"density": 2.8561806590840324,
"density_atomic": 0.0441553879119565,
"volume": 430.2985637423227,
"volume_molar": 13.638518524642631,
"formula_full": "Sc7 Cl12",
"formula_reduced": "Sc7Cl12",
"formula_anonymous": "A7B12",
"energy_above_hull": 1.1897429242105262,
"spacegroup": 148
},
{
"id": "jvasp-86377",
"created_at": "2022-09-04T14:35:58.603615Z",
"updated_at": "2022-09-04T14:35:58.603635Z",
"structure_string": "Ce7 O12\n1.0\n6.679356 -0.017567 -1.117982\n-1.317814 6.548089 -1.117983\n-0.014423 -0.017567 6.772257\nCe O\n7 12\ndirect\n0.000000 0.000000 0.000000 Ce\n0.138827 0.600910 0.299492 Ce\n0.299492 0.138826 0.600910 Ce\n0.399091 0.700508 0.861175 Ce\n0.861175 0.399089 0.700509 Ce\n0.700509 0.861173 0.399091 Ce\n0.600910 0.299492 0.138827 Ce\n0.566231 0.417885 0.822316 O\n0.417886 0.822315 0.566231 O\n0.932094 0.072310 0.678398 O\n0.582115 0.177684 0.433770 O\n0.822316 0.566230 0.417886 O\n0.321603 0.067906 0.927690 O\n0.927690 0.321602 0.067907 O\n0.067908 0.927689 0.321603 O\n0.678399 0.932093 0.072311 O\n0.072311 0.678397 0.932094 O\n0.433770 0.582115 0.177685 O\n0.177685 0.433769 0.582115 O\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Ce",
"O"
],
"chemical_system": "Ce-O",
"density": 6.584276511871063,
"density_atomic": 0.06423723363411274,
"volume": 295.7786150664835,
"volume_molar": 9.374844493306425,
"formula_full": "Ce7 O12",
"formula_reduced": "Ce7O12",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.754658289473684,
"spacegroup": 148
},
{
"id": "jvasp-112610",
"created_at": "2022-09-04T14:38:42.151566Z",
"updated_at": "2022-09-04T14:38:42.151600Z",
"structure_string": "Al12 Fe7\n1.0\n4.615034 -0.020751 1.267996\n0.724639 6.303184 0.244025\n0.009831 0.000018 8.726940\nAl Fe\n12 7\ndirect\n0.412333 0.460346 0.302251 Al\n0.506926 0.992454 0.831599 Al\n0.493073 0.007546 0.168403 Al\n0.009826 0.294763 0.174888 Al\n0.687967 0.336207 0.968347 Al\n0.312032 0.663793 0.031655 Al\n0.990173 0.705237 0.825113 Al\n0.601968 0.186538 0.514419 Al\n0.961214 0.869707 0.292533 Al\n0.038785 0.130293 0.707468 Al\n0.587666 0.539654 0.697750 Al\n0.398032 0.813461 0.485582 Al\n0.163830 0.479044 0.584665 Fe\n0.225134 0.350799 0.883703 Fe\n0.774865 0.649201 0.116298 Fe\n0.144711 0.153818 0.414875 Fe\n0.855288 0.846182 0.585126 Fe\n0.000000 0.000000 0.000000 Fe\n0.836169 0.520956 0.415336 Fe\n",
"nsites": 19,
"nelements": 2,
"elements": [
"Al",
"Fe"
],
"chemical_system": "Al-Fe",
"density": 4.67392835674482,
"density_atomic": 0.07482844920020483,
"volume": 253.91412227674485,
"volume_molar": 8.047929396328469,
"formula_full": "Al12 Fe7",
"formula_reduced": "Al12Fe7",
"formula_anonymous": "A7B12",
"energy_above_hull": 2.921933268421053,
"spacegroup": 2
}
]
}