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=4439",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=4437",
"results": [
{
"id": "jvasp-94163",
"created_at": "2022-09-04T14:36:19.717960Z",
"updated_at": "2022-09-04T14:36:19.717996Z",
"structure_string": "Mg6 Cr1 Cu1\n1.0\n6.114006 -0.013840 0.000000\n-3.068990 5.315645 0.000000\n0.000000 0.000000 4.850946\nMg Cr Cu\n6 1 1\ndirect\n0.665446 0.334694 0.250000 Mg\n0.665446 0.830751 0.250000 Mg\n0.324317 0.163732 0.750001 Mg\n0.324316 0.660585 0.750001 Mg\n0.845907 0.172954 0.750001 Mg\n0.842594 0.671297 0.750001 Mg\n0.164826 0.832411 0.250000 Cr\n0.167148 0.333574 0.250000 Cu\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"Cr",
"Cu"
],
"chemical_system": "Cr-Cu-Mg",
"density": 2.7565635866133005,
"density_atomic": 0.05081005643130998,
"volume": 157.44914613143925,
"volume_molar": 11.852261506816708,
"formula_full": "Mg6 Cr1 Cu1",
"formula_reduced": "Mg6CrCu",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 38
},
{
"id": "jvasp-86530",
"created_at": "2022-09-04T14:36:16.510567Z",
"updated_at": "2022-09-04T14:36:16.510588Z",
"structure_string": "Nb1 Fe1 F6\n1.0\n4.703647 0.077814 3.144337\n1.720540 4.378365 3.144336\n0.112180 0.077814 5.656727\nNb Fe F\n1 1 6\ndirect\n0.500000 0.500000 0.500001 Nb\n0.000000 0.000000 0.000000 Fe\n0.373554 0.130097 0.748716 F\n0.748715 0.373553 0.130098 F\n0.130098 0.748715 0.373554 F\n0.626447 0.869902 0.251286 F\n0.251286 0.626446 0.869903 F\n0.869903 0.251284 0.626448 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Nb",
"Fe",
"F"
],
"chemical_system": "F-Fe-Nb",
"density": 3.8442597367266673,
"density_atomic": 0.07048950210756999,
"volume": 113.49207698745919,
"volume_molar": 8.543315784540448,
"formula_full": "Nb1 Fe1 F6",
"formula_reduced": "NbFeF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.8384608243749999,
"spacegroup": 148
},
{
"id": "jvasp-26471",
"created_at": "2022-09-04T14:37:53.730913Z",
"updated_at": "2022-09-04T14:37:53.730944Z",
"structure_string": "Ni1 Rh1 F6\n1.0\n4.386518 0.053758 3.025614\n1.617015 4.077952 3.025614\n0.078113 0.053758 5.328206\nNi Rh F\n1 1 6\ndirect\n0.499999 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Rh\n0.404042 0.094093 0.752640 F\n0.094091 0.752639 0.404043 F\n0.247359 0.595958 0.905908 F\n0.905907 0.247361 0.595957 F\n0.595956 0.905908 0.247360 F\n0.752639 0.404043 0.094092 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ni",
"Rh",
"F"
],
"chemical_system": "F-Ni-Rh",
"density": 4.89721752987496,
"density_atomic": 0.08561067139480993,
"volume": 93.44629436564601,
"volume_molar": 7.034334227128939,
"formula_full": "Ni1 Rh1 F6",
"formula_reduced": "NiRhF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.2302671368749999,
"spacegroup": 148
},
{
"id": "jvasp-25592",
"created_at": "2022-09-04T14:37:53.472805Z",
"updated_at": "2022-09-04T14:37:53.472831Z",
"structure_string": "Zr1 V1 F6\n1.0\n4.959057 -0.000000 2.863114\n1.653019 4.675445 2.863114\n-0.000000 -0.000000 5.726226\nZr V F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Zr\n0.500001 0.500000 0.500000 V\n0.746239 0.253761 0.746238 F\n0.253762 0.746238 0.746239 F\n0.253762 0.746238 0.253761 F\n0.253762 0.253761 0.746239 F\n0.746239 0.746238 0.253761 F\n0.746239 0.253761 0.253761 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zr",
"V",
"F"
],
"chemical_system": "F-V-Zr",
"density": 3.20378199366984,
"density_atomic": 0.060255882267820485,
"volume": 132.76712080062566,
"volume_molar": 9.994278622016147,
"formula_full": "Zr1 V1 F6",
"formula_reduced": "ZrVF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.7286862993750001,
"spacegroup": 225
},
{
"id": "jvasp-2748",
"created_at": "2022-09-04T14:37:50.397986Z",
"updated_at": "2022-09-04T14:37:50.397998Z",
"structure_string": "Zn1 Pt1 F6\n1.0\n4.439987 0.014124 3.182475\n1.642092 4.125192 3.182475\n0.020753 0.014124 5.462709\nZn Pt F\n1 1 6\ndirect\n0.500000 0.499999 0.500000 Zn\n0.000000 0.000000 0.000000 Pt\n0.402634 0.085939 0.757974 F\n0.085940 0.757973 0.402634 F\n0.242026 0.597365 0.914060 F\n0.914060 0.242025 0.597366 F\n0.597366 0.914058 0.242025 F\n0.757975 0.402633 0.085939 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Zn",
"Pt",
"F"
],
"chemical_system": "F-Pt-Zn",
"density": 6.247814413607055,
"density_atomic": 0.08037785584094244,
"volume": 99.52990057150794,
"volume_molar": 7.492288388380317,
"formula_full": "Zn1 Pt1 F6",
"formula_reduced": "ZnPtF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-29341",
"created_at": "2022-09-04T14:37:50.581511Z",
"updated_at": "2022-09-04T14:37:50.581529Z",
"structure_string": "Bi4 Au4 Br24\n1.0\n7.266249 -0.009382 -0.544875\n-3.839038 9.580459 -2.790226\n-0.006312 -0.099484 14.532175\nBi Au Br\n4 4 24\ndirect\n0.590789 0.921489 0.620164 Bi\n0.409212 0.078512 0.379837 Bi\n0.977141 0.312427 0.869749 Bi\n0.022859 0.687573 0.130252 Bi\n0.299778 0.635096 0.765486 Au\n0.700223 0.364905 0.234515 Au\n0.500000 0.500000 0.500000 Au\n0.000000 0.000000 0.000000 Au\n0.243941 0.895389 0.030530 Br\n0.734286 0.800164 0.025059 Br\n0.265714 0.199836 0.974941 Br\n0.590053 0.184694 0.738838 Br\n0.759700 0.046573 0.482920 Br\n0.993929 0.057903 0.723948 Br\n0.006071 0.942097 0.276053 Br\n0.756060 0.104611 0.969470 Br\n0.240300 0.953428 0.517080 Br\n0.409948 0.815306 0.261163 Br\n0.214415 0.285822 0.489717 Br\n0.654887 0.581828 0.227853 Br\n0.275998 0.627292 0.493156 Br\n0.724002 0.372709 0.506844 Br\n0.727387 0.436857 0.978518 Br\n0.345113 0.418173 0.772148 Br\n0.049503 0.467723 0.218512 Br\n0.950497 0.532278 0.781488 Br\n0.752646 0.154477 0.249506 Br\n0.247355 0.845523 0.750494 Br\n0.350535 0.258176 0.247748 Br\n0.649466 0.741825 0.752252 Br\n0.785586 0.714179 0.510283 Br\n0.272613 0.563144 0.021482 Br\n",
"nsites": 32,
"nelements": 3,
"elements": [
"Bi",
"Au",
"Br"
],
"chemical_system": "Au-Bi-Br",
"density": 5.829119217938623,
"density_atomic": 0.0317189315471026,
"volume": 1008.8612207028478,
"volume_molar": 18.985950869931177,
"formula_full": "Bi4 Au4 Br24",
"formula_reduced": "BiAuBr6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0638958124999999,
"spacegroup": 2
},
{
"id": "jvasp-92199",
"created_at": "2022-09-04T14:37:41.280447Z",
"updated_at": "2022-09-04T14:37:41.280465Z",
"structure_string": "K1 Mg6 Ti1\n1.0\n6.600542 0.000992 0.000000\n-3.299413 5.716733 0.000000\n0.000000 0.000000 5.154630\nK Mg Ti\n1 6 1\ndirect\n0.416654 0.083345 0.750000 K\n0.064629 0.907242 0.250000 Mg\n0.592757 0.435371 0.250000 Mg\n0.592668 0.907331 0.250000 Mg\n0.397148 0.573576 0.750000 Mg\n0.926424 0.102852 0.750000 Mg\n0.926389 0.573610 0.750000 Mg\n0.083332 0.416668 0.250000 Ti\n",
"nsites": 8,
"nelements": 3,
"elements": [
"K",
"Mg",
"Ti"
],
"chemical_system": "K-Mg-Ti",
"density": 1.9872871819112805,
"density_atomic": 0.041127026685329984,
"volume": 194.51928925495605,
"volume_molar": 14.64278175535626,
"formula_full": "K1 Mg6 Ti1",
"formula_reduced": "KMg6Ti",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 187
},
{
"id": "jvasp-21474",
"created_at": "2022-09-04T14:37:52.038134Z",
"updated_at": "2022-09-04T14:37:52.038171Z",
"structure_string": "Zr2 Pb2 F12\n1.0\n5.348324 0.000000 -0.000000\n0.000000 6.314205 -2.519373\n-0.000000 -0.009522 6.798260\nZr Pb F\n2 2 12\ndirect\n0.000000 0.750000 0.750000 Zr\n0.000000 0.250000 0.250000 Zr\n0.463159 0.750000 0.250000 Pb\n0.536840 0.250000 0.750000 Pb\n0.743089 0.440849 0.184228 F\n0.743089 0.059151 0.315772 F\n0.256910 0.184228 0.440849 F\n0.256910 0.315771 0.059151 F\n0.838074 0.429468 0.570532 F\n0.838074 0.070532 0.929468 F\n0.161925 0.570532 0.429468 F\n0.161925 0.929467 0.070532 F\n0.743089 0.684228 0.940850 F\n0.743089 0.815771 0.559151 F\n0.256910 0.940849 0.684229 F\n0.256910 0.559151 0.815772 F\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Zr",
"Pb",
"F"
],
"chemical_system": "F-Pb-Zr",
"density": 5.969274570105444,
"density_atomic": 0.06973143524596973,
"volume": 229.45175219127233,
"volume_molar": 8.636192183278004,
"formula_full": "Zr2 Pb2 F12",
"formula_reduced": "ZrPbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.108234626875,
"spacegroup": 67
},
{
"id": "jvasp-26524",
"created_at": "2022-09-04T14:37:41.971000Z",
"updated_at": "2022-09-04T14:37:41.971030Z",
"structure_string": "Rb1 Cr1 F6\n1.0\n4.918895 -0.005066 -0.617318\n-0.699009 4.868978 -0.617317\n-0.004395 -0.005066 4.957478\nRb Cr F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Rb\n0.500001 0.499999 0.500000 Cr\n0.197359 0.303818 0.576878 F\n0.303819 0.576878 0.197358 F\n0.423123 0.802641 0.696181 F\n0.696183 0.423121 0.802641 F\n0.802642 0.696181 0.423121 F\n0.576879 0.197358 0.303818 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Rb",
"Cr",
"F"
],
"chemical_system": "Cr-F-Rb",
"density": 3.518187009120293,
"density_atomic": 0.06740633436292978,
"volume": 118.68320797458485,
"volume_molar": 8.934087303391305,
"formula_full": "Rb1 Cr1 F6",
"formula_reduced": "RbCrF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.1775136628124994,
"spacegroup": 148
},
{
"id": "jvasp-3264",
"created_at": "2022-09-04T14:37:40.280978Z",
"updated_at": "2022-09-04T14:37:40.281004Z",
"structure_string": "Cd1 Pd1 F6\n1.0\n4.559390 0.013280 3.371710\n1.707423 4.227638 3.371710\n0.019624 0.013280 5.670634\nCd Pd F\n1 1 6\ndirect\n0.499999 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Pd\n0.398143 0.054418 0.780851 F\n0.054417 0.780852 0.398144 F\n0.219147 0.601856 0.945582 F\n0.945581 0.219149 0.601856 F\n0.601855 0.945582 0.219149 F\n0.780851 0.398144 0.054418 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Cd",
"Pd",
"F"
],
"chemical_system": "Cd-F-Pd",
"density": 5.081075479436893,
"density_atomic": 0.07355043875115547,
"volume": 108.76889568349885,
"volume_molar": 8.187770001447332,
"formula_full": "Cd1 Pd1 F6",
"formula_reduced": "CdPdF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0,
"spacegroup": 148
},
{
"id": "jvasp-106878",
"created_at": "2022-09-04T14:37:52.491208Z",
"updated_at": "2022-09-04T14:37:52.491218Z",
"structure_string": "Ni1 Pb1 F6\n1.0\n4.562485 0.055710 3.257844\n1.706921 4.231523 3.257844\n0.081467 0.055710 5.605637\nNi Pb F\n1 1 6\ndirect\n0.000000 0.000000 0.000000 Ni\n0.500000 0.500000 0.500000 Pb\n0.602496 0.926647 0.232017 F\n0.926647 0.232018 0.602497 F\n0.767982 0.397503 0.073352 F\n0.073353 0.767982 0.397503 F\n0.397503 0.073352 0.767982 F\n0.232018 0.602496 0.926647 F\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ni",
"Pb",
"F"
],
"chemical_system": "F-Ni-Pb",
"density": 5.947449588349076,
"density_atomic": 0.07542596296277222,
"volume": 106.06427396821618,
"volume_molar": 7.984174843047521,
"formula_full": "Ni1 Pb1 F6",
"formula_reduced": "NiPbF6",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.0011987499999999,
"spacegroup": 148
},
{
"id": "jvasp-110291",
"created_at": "2022-09-04T14:37:52.510084Z",
"updated_at": "2022-09-04T14:37:52.510113Z",
"structure_string": "Al1 Cr6 Si1\n1.0\n4.542875 0.000000 0.000000\n0.000000 4.542875 0.000000\n-0.000000 -0.000000 4.542875\nAl Cr Si\n1 6 1\ndirect\n0.500001 0.500001 0.500001 Al\n-0.000000 0.500001 0.754183 Cr\n0.500001 0.245818 -0.000000 Cr\n0.754183 0.000000 0.500001 Cr\n-0.000000 0.500001 0.245818 Cr\n0.500001 0.754183 -0.000000 Cr\n0.245818 0.000000 0.500001 Cr\n0.000000 0.000000 0.000000 Si\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Cr",
"Si"
],
"chemical_system": "Al-Cr-Si",
"density": 6.500914252220895,
"density_atomic": 0.08532919052005838,
"volume": 93.7545516515762,
"volume_molar": 7.05753883670603,
"formula_full": "Al1 Cr6 Si1",
"formula_reduced": "AlCr6Si",
"formula_anonymous": "ABC6",
"energy_above_hull": 4.860594475,
"spacegroup": 200
}
]
}