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=4583",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4581",
"results": [
{
"id": "jvasp-27052",
"created_at": "2022-09-04T14:38:32.939119Z",
"updated_at": "2022-09-04T14:38:32.939151Z",
"structure_string": "Tl4 P4 Pb4 S16\n1.0\n6.614424 0.000000 0.000000\n0.000000 8.675909 0.000000\n0.000000 0.000000 12.496355\nTl P Pb S\n4 4 4 16\ndirect\n0.750000 0.624803 0.393805 Tl\n0.250000 0.375197 0.606195 Tl\n0.250000 0.124803 0.106195 Tl\n0.750000 0.875197 0.893805 Tl\n0.250000 0.873399 0.346998 P\n0.750000 0.126601 0.653003 P\n0.750000 0.373399 0.153003 P\n0.250000 0.626601 0.846998 P\n0.250000 0.607594 0.129838 Pb\n0.750000 0.392406 0.870163 Pb\n0.750000 0.107594 0.370162 Pb\n0.250000 0.892406 0.629838 Pb\n0.498427 0.863811 0.247929 S\n0.998426 0.136189 0.752072 S\n0.498427 0.636189 0.747929 S\n0.998426 0.363811 0.252071 S\n0.501573 0.136189 0.752072 S\n0.001573 0.863811 0.247929 S\n0.250000 0.421959 0.931848 S\n0.750000 0.314037 0.551567 S\n0.750000 0.921960 0.568152 S\n0.250000 0.078041 0.431848 S\n0.250000 0.814037 0.948434 S\n0.750000 0.185963 0.051566 S\n0.001573 0.636189 0.747929 S\n0.250000 0.685963 0.448434 S\n0.750000 0.578041 0.068152 S\n0.501573 0.363811 0.252071 S\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Tl",
"P",
"Pb",
"S"
],
"chemical_system": "P-Pb-S-Tl",
"density": 5.287077317839833,
"density_atomic": 0.039045200578861565,
"volume": 717.1175864098069,
"volume_molar": 15.42351088154043,
"formula_full": "Tl4 P4 Pb4 S16",
"formula_reduced": "TlPPbS4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.5849569885714287,
"spacegroup": 62
},
{
"id": "jvasp-103118",
"created_at": "2022-09-04T14:38:40.190165Z",
"updated_at": "2022-09-04T14:38:40.190180Z",
"structure_string": "Ca1 La1 Fe1 O4\n1.0\n3.700870 0.126118 -5.753021\n-0.214246 3.696815 -5.753021\n-0.115023 -0.126118 6.839624\nCa La Fe O\n1 1 1 4\ndirect\n0.640595 0.640596 0.000001 Ca\n0.354232 0.354233 0.000000 La\n0.006303 0.006303 0.000000 Fe\n0.825053 0.825055 0.000001 O\n0.172382 0.172382 0.000000 O\n0.000717 0.500718 0.500000 O\n0.500718 0.000717 0.500000 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Ca",
"La",
"Fe",
"O"
],
"chemical_system": "Ca-Fe-La-O",
"density": 5.603299606298307,
"density_atomic": 0.07904498182795598,
"volume": 88.55717134878634,
"volume_molar": 7.618625016711863,
"formula_full": "Ca1 La1 Fe1 O4",
"formula_reduced": "CaLaFeO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.9693949885714288,
"spacegroup": 107
},
{
"id": "jvasp-110997",
"created_at": "2022-09-04T14:38:37.074081Z",
"updated_at": "2022-09-04T14:38:37.074105Z",
"structure_string": "Sr1 Nd1 Ga1 O4\n1.0\n3.697548 0.012152 -5.740620\n-0.309818 3.684565 -5.740620\n-0.011136 -0.012152 6.828356\nSr Nd Ga O\n1 1 1 4\ndirect\n0.643796 0.643796 0.000000 Sr\n0.359975 0.359975 0.000000 Nd\n0.006399 0.006399 0.000000 Ga\n0.992108 0.492109 0.500000 O\n0.492108 0.992110 0.500001 O\n0.834737 0.834737 0.000000 O\n0.170877 0.170877 0.000000 O\n",
"nsites": 7,
"nelements": 4,
"elements": [
"Sr",
"Nd",
"Ga",
"O"
],
"chemical_system": "Ga-Nd-O-Sr",
"density": 6.5600246970006495,
"density_atomic": 0.07564302701946575,
"volume": 92.5399243766202,
"volume_molar": 7.961263578796601,
"formula_full": "Sr1 Nd1 Ga1 O4",
"formula_reduced": "SrNdGaO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.2551977335714288,
"spacegroup": 107
},
{
"id": "jvasp-56706",
"created_at": "2022-09-04T14:38:33.629077Z",
"updated_at": "2022-09-04T14:38:33.629098Z",
"structure_string": "Tb2 Mo2 Cl2 O8\n1.0\n6.114687 0.002204 1.510404\n1.780334 5.849772 1.510404\n0.012631 0.009363 6.866626\nTb Mo Cl O\n2 2 2 8\ndirect\n0.221773 0.221772 0.890793 Tb\n0.778227 0.778227 0.109208 Tb\n0.362515 0.362514 0.269681 Mo\n0.637485 0.637484 0.730318 Mo\n0.009247 0.009247 0.238323 Cl\n0.990753 0.990752 0.761676 Cl\n0.294499 0.294498 0.535222 O\n0.509995 0.888366 0.846687 O\n0.705501 0.705500 0.464778 O\n0.458477 0.458477 0.797477 O\n0.111633 0.490004 0.153312 O\n0.888367 0.509994 0.846687 O\n0.490005 0.111633 0.153312 O\n0.541523 0.541522 0.202523 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Tb",
"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Mo-O-Tb",
"density": 4.794757615444146,
"density_atomic": 0.05704596052248157,
"volume": 245.41614992147709,
"volume_molar": 10.556647140031414,
"formula_full": "Tb2 Mo2 Cl2 O8",
"formula_reduced": "TbMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4124674810714293,
"spacegroup": 12
},
{
"id": "jvasp-119348",
"created_at": "2022-09-04T14:38:31.147495Z",
"updated_at": "2022-09-04T14:38:31.147525Z",
"structure_string": "Li2 Co2 Ni2 O8\n1.0\n4.913067 -0.007566 -2.829625\n-1.636060 4.638568 -2.819939\n-0.016893 0.007566 5.669631\nLi Co Ni O\n2 2 2 8\ndirect\n0.128882 0.878882 0.250000 Li\n0.871119 0.121118 0.750000 Li\n0.000000 0.500001 0.500000 Co\n0.500000 0.500000 -0.000001 Co\n0.500001 0.500000 0.500000 Ni\n0.500000 -0.000000 -0.000001 Ni\n0.263517 0.292335 0.528818 O\n0.263309 0.736502 0.526807 O\n0.709695 0.736502 0.973193 O\n0.263518 0.734701 0.971182 O\n0.736484 0.265300 0.028817 O\n0.736693 0.263499 0.473193 O\n0.290307 0.263499 0.026806 O\n0.736484 0.707665 0.471182 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Co",
"Ni",
"O"
],
"chemical_system": "Co-Li-Ni-O",
"density": 4.852458515929358,
"density_atomic": 0.10847989077496568,
"volume": 129.05617714016756,
"volume_molar": 5.551389033468452,
"formula_full": "Li2 Co2 Ni2 O8",
"formula_reduced": "LiCoNiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.183956757142857,
"spacegroup": 74
},
{
"id": "jvasp-44793",
"created_at": "2022-09-04T14:38:33.629570Z",
"updated_at": "2022-09-04T14:38:33.629599Z",
"structure_string": "Li2 Ti2 Ni2 O8\n1.0\n5.941530 -0.000000 0.000000\n2.970765 4.983092 -0.122557\n2.970765 1.545482 4.738956\nLi Ti Ni O\n2 2 2 8\ndirect\n0.118978 0.131022 0.131022 Li\n0.881024 0.868977 0.868978 Li\n0.500000 -0.000000 0.500000 Ti\n0.500001 0.500000 -0.000000 Ti\n0.000001 0.500000 0.500000 Ni\n0.500001 0.500000 0.500000 Ni\n0.268746 0.258511 0.258511 O\n0.257104 0.268675 0.717119 O\n0.257104 0.717118 0.268676 O\n0.714233 0.258511 0.258511 O\n0.285769 0.741488 0.741489 O\n0.742898 0.731324 0.282882 O\n0.742898 0.282881 0.731325 O\n0.731256 0.741488 0.741489 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Ti",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-Ti",
"density": 4.1679798598381455,
"density_atomic": 0.09898710971118219,
"volume": 141.43255663134565,
"volume_molar": 6.083762600575964,
"formula_full": "Li2 Ti2 Ni2 O8",
"formula_reduced": "LiTiNiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.162116390476191,
"spacegroup": 74
},
{
"id": "jvasp-23052",
"created_at": "2022-09-04T14:38:30.803134Z",
"updated_at": "2022-09-04T14:38:30.803159Z",
"structure_string": "Li6 Ga6 Si6 O24\n1.0\n8.088988 -0.000969 -2.604338\n-3.574221 7.256490 -2.604339\n-0.000603 -0.000969 8.497899\nLi Ga Si O\n6 6 6 24\ndirect\n0.210049 0.434551 0.607161 Li\n0.724755 0.126792 0.893393 Li\n0.126793 0.893393 0.724755 Li\n0.893394 0.724755 0.126792 Li\n0.434552 0.607161 0.210048 Li\n0.607161 0.210048 0.434552 Li\n0.768603 0.944624 0.534143 Ga\n0.459453 0.234184 0.054070 Ga\n0.054070 0.459452 0.234184 Ga\n0.234184 0.054070 0.459452 Ga\n0.944625 0.534143 0.768602 Ga\n0.534144 0.768602 0.944624 Ga\n0.796388 0.567200 0.387829 Si\n0.387830 0.796387 0.567200 Si\n0.567200 0.387829 0.796387 Si\n0.097609 0.280879 0.873459 Si\n0.873459 0.097609 0.280879 Si\n0.280879 0.873459 0.097609 Si\n0.989196 0.975469 0.308444 O\n0.702762 0.376741 0.694441 O\n0.354823 0.299386 0.633884 O\n0.633884 0.354823 0.299386 O\n0.006946 0.060707 0.727165 O\n0.580495 0.262308 0.909738 O\n0.262309 0.909738 0.580495 O\n0.909738 0.580494 0.262308 O\n0.404975 0.758348 0.085323 O\n0.758348 0.085324 0.404975 O\n0.085324 0.404975 0.758348 O\n0.021514 0.310705 0.353853 O\n0.310705 0.353853 0.021513 O\n0.353853 0.021514 0.310705 O\n0.060707 0.727165 0.006945 O\n0.636536 0.603389 0.939313 O\n0.603390 0.939313 0.636535 O\n0.376742 0.694441 0.702762 O\n0.694442 0.702762 0.376741 O\n0.299386 0.633884 0.354823 O\n0.308445 0.989195 0.975469 O\n0.975470 0.308444 0.989195 O\n0.727165 0.006945 0.060707 O\n0.939313 0.636535 0.603389 O\n",
"nsites": 42,
"nelements": 4,
"elements": [
"Li",
"Ga",
"Si",
"O"
],
"chemical_system": "Ga-Li-O-Si",
"density": 3.371052280796621,
"density_atomic": 0.08421280096608659,
"volume": 498.7365283920892,
"volume_molar": 7.151098990787852,
"formula_full": "Li6 Ga6 Si6 O24",
"formula_reduced": "LiGaSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.7628407035714289,
"spacegroup": 146
},
{
"id": "jvasp-119747",
"created_at": "2022-09-04T14:38:37.024117Z",
"updated_at": "2022-09-04T14:38:37.024151Z",
"structure_string": "Li4 V4 Ni4 O16\n1.0\n4.839407 0.000004 -0.000124\n-0.000005 5.940874 -0.000000\n0.000262 -0.000000 10.161987\nLi V Ni O\n4 4 4 16\ndirect\n1.000000 -0.000001 0.000001 Li\n0.500000 -0.000000 0.500000 Li\n1.000001 0.500000 0.000001 Li\n0.500001 0.500000 0.500001 Li\n0.428804 0.249999 0.094690 V\n0.071198 0.250000 0.594691 V\n0.928803 0.749999 0.405311 V\n0.571197 0.749999 0.905310 V\n0.003664 0.750000 0.734040 Ni\n0.996339 0.249999 0.265961 Ni\n0.496337 0.749999 0.234040 Ni\n0.503664 0.250000 0.765961 Ni\n0.772248 0.515047 0.331304 O\n0.727754 0.515047 0.831304 O\n0.227753 0.484951 0.668697 O\n0.272247 0.484950 0.168697 O\n0.227753 0.015048 0.668697 O\n0.272247 0.015048 0.168697 O\n0.213829 0.749999 0.905321 O\n0.293950 0.250000 0.937174 O\n0.713830 0.249999 0.594681 O\n0.786170 0.249999 0.094680 O\n0.706051 0.749999 0.062828 O\n0.793951 0.749999 0.562828 O\n0.772248 0.984951 0.331304 O\n0.206051 0.250000 0.437173 O\n0.286172 0.749999 0.405320 O\n0.727754 0.984951 0.831304 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"V",
"Ni",
"O"
],
"chemical_system": "Li-Ni-O-V",
"density": 4.105272401126392,
"density_atomic": 0.09583781555094698,
"volume": 292.16024842631475,
"volume_molar": 6.2836790732137,
"formula_full": "Li4 V4 Ni4 O16",
"formula_reduced": "LiVNiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.274232942857143,
"spacegroup": 62
},
{
"id": "jvasp-112510",
"created_at": "2022-09-04T14:38:40.674126Z",
"updated_at": "2022-09-04T14:38:40.674152Z",
"structure_string": "Li2 Mn2 Co2 O8\n1.0\n4.972010 -0.001882 -2.678346\n-1.640646 4.673925 -2.710689\n-0.019996 -0.106641 5.645293\nLi Mn Co O\n2 2 2 8\ndirect\n-0.000001 0.499999 -0.000001 Li\n-0.000000 0.000000 0.500000 Li\n0.499999 0.500000 0.499999 Mn\n0.500000 0.000000 -0.000000 Mn\n0.000000 0.000000 0.000000 Co\n0.500000 0.000000 0.499999 Co\n0.741262 0.211959 0.970801 O\n0.279272 0.757445 0.521686 O\n0.258850 0.229527 0.470799 O\n0.735752 0.757572 -0.021706 O\n0.264247 0.242427 0.021704 O\n0.741148 0.770473 0.529198 O\n0.720727 0.242555 0.478311 O\n0.258736 0.788041 0.029196 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"Mn",
"Co",
"O"
],
"chemical_system": "Co-Li-Mn-O",
"density": 4.757296027510356,
"density_atomic": 0.10851356414349854,
"volume": 129.01612909411375,
"volume_molar": 5.549666355107746,
"formula_full": "Li2 Mn2 Co2 O8",
"formula_reduced": "LiMnCoO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.660793163054187,
"spacegroup": 74
},
{
"id": "jvasp-44128",
"created_at": "2022-09-04T14:38:32.781788Z",
"updated_at": "2022-09-04T14:38:32.781802Z",
"structure_string": "Li4 Nb4 Ni4 O16\n1.0\n6.003903 0.000000 0.000000\n0.000000 6.003903 -0.000000\n0.000000 -0.000000 8.537751\nLi Nb Ni O\n4 4 4 16\ndirect\n0.000000 0.240021 0.000000 Li\n0.000000 0.759978 0.500000 Li\n0.240021 0.000000 0.250000 Li\n0.759978 0.000000 0.750000 Li\n0.253076 0.253076 0.625000 Nb\n0.253076 0.746924 0.875000 Nb\n0.746924 0.253076 0.375000 Nb\n0.746924 0.746924 0.125000 Nb\n0.755234 0.500000 0.750000 Ni\n0.500000 0.755234 0.500000 Ni\n0.500000 0.244765 0.000000 Ni\n0.244765 0.500000 0.250000 Ni\n0.743090 0.993042 0.497399 O\n0.743090 0.006957 0.002601 O\n0.742593 0.492667 0.990656 O\n0.742593 0.507333 0.509344 O\n0.507333 0.742593 0.740656 O\n0.507333 0.257407 0.759344 O\n0.492667 0.742593 0.259344 O\n0.006957 0.743090 0.247399 O\n0.257407 0.507333 0.490656 O\n0.257407 0.492667 0.009344 O\n0.256910 0.993042 0.502601 O\n0.256910 0.006957 0.997399 O\n0.993042 0.256910 0.747399 O\n0.006957 0.256910 0.252601 O\n0.492667 0.257407 0.240656 O\n0.993042 0.743090 0.752601 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Nb",
"Ni",
"O"
],
"chemical_system": "Li-Nb-Ni-O",
"density": 4.8028961048213565,
"density_atomic": 0.09098026815068816,
"volume": 307.7590401648889,
"volume_molar": 6.6191723572694805,
"formula_full": "Li4 Nb4 Ni4 O16",
"formula_reduced": "LiNbNiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.4526808285714288,
"spacegroup": 95
},
{
"id": "jvasp-56672",
"created_at": "2022-09-04T14:38:30.919075Z",
"updated_at": "2022-09-04T14:38:30.919097Z",
"structure_string": "Y2 Mo2 Cl2 O8\n1.0\n6.094277 -0.002274 1.518874\n1.778964 5.828850 1.518874\n0.009334 0.006908 6.859892\nY Mo Cl O\n2 2 2 8\ndirect\n0.778352 0.778353 0.110256 Y\n0.221646 0.221648 0.889743 Y\n0.362654 0.362654 0.269265 Mo\n0.637345 0.637347 0.730734 Mo\n0.990215 0.990217 0.762517 Cl\n0.009784 0.009784 0.237482 Cl\n0.889515 0.509246 0.846258 O\n0.110483 0.490755 0.153740 O\n0.457696 0.457698 0.798704 O\n0.294801 0.294802 0.535285 O\n0.542302 0.542303 0.201295 O\n0.705198 0.705199 0.464714 O\n0.490754 0.110484 0.153740 O\n0.509244 0.889517 0.846259 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Y",
"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Mo-O-Y",
"density": 3.8762054723952177,
"density_atomic": 0.05747570356316166,
"volume": 243.58118530232534,
"volume_molar": 10.477715602701759,
"formula_full": "Y2 Mo2 Cl2 O8",
"formula_reduced": "YMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.6526999167857146,
"spacegroup": 12
},
{
"id": "jvasp-56708",
"created_at": "2022-09-04T14:38:33.819219Z",
"updated_at": "2022-09-04T14:38:33.819245Z",
"structure_string": "Lu2 Mo2 Cl2 O8\n1.0\n5.848818 0.024660 -0.002164\n2.098974 6.131654 -0.024067\n1.442069 1.560334 6.503624\nLu Mo Cl O\n2 2 2 8\ndirect\n0.758517 0.801442 0.130263 Lu\n0.241483 0.198557 0.869736 Lu\n0.617454 0.645694 0.731792 Mo\n0.382547 0.354305 0.268207 Mo\n0.009954 0.026249 0.231388 Cl\n0.990046 0.973749 0.768611 Cl\n0.093902 0.522848 0.196547 O\n0.906099 0.477151 0.803453 O\n0.357084 0.243690 0.534562 O\n0.584204 0.521604 0.201715 O\n0.642916 0.756309 0.465437 O\n0.480966 0.133507 0.125244 O\n0.519034 0.866491 0.874755 O\n0.415796 0.478395 0.798285 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Lu",
"Mo",
"Cl",
"O"
],
"chemical_system": "Cl-Lu-Mo-O",
"density": 5.27589607336041,
"density_atomic": 0.06005150740776273,
"volume": 233.13319855465028,
"volume_molar": 10.028292410893803,
"formula_full": "Lu2 Mo2 Cl2 O8",
"formula_reduced": "LuMoClO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.3969842453571437,
"spacegroup": 2
}
]
}