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=-volume_molar&page=4022",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-volume_molar&page=4020",
"results": [
{
"id": "jvasp-20134",
"created_at": "2022-09-04T14:38:29.238229Z",
"updated_at": "2022-09-04T14:38:29.238262Z",
"structure_string": "Mg2 F4\n1.0\n4.652103 0.000000 0.000000\n-0.000000 4.652103 0.000000\n0.000000 0.000000 3.072442\nMg F\n2 4\ndirect\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n0.697167 0.697167 0.000000 F\n0.197167 0.802832 0.500000 F\n0.302832 0.302832 0.000000 F\n0.802832 0.197167 0.500000 F\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Mg",
"F"
],
"chemical_system": "F-Mg",
"density": 3.111697675712191,
"density_atomic": 0.09023373074546749,
"volume": 66.49398124660145,
"volume_molar": 6.673935245997236,
"formula_full": "Mg2 F4",
"formula_reduced": "MgF2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0002299999999999,
"spacegroup": 136
},
{
"id": "jvasp-97685",
"created_at": "2022-09-04T14:36:00.983043Z",
"updated_at": "2022-09-04T14:36:00.983071Z",
"structure_string": "Ca12 Mn8 Si12 O48\n1.0\n9.882427 0.000000 -3.493966\n-4.941214 8.558433 -3.493966\n-0.000000 -0.000000 10.481897\nCa Mn Si O\n12 8 12 48\ndirect\n0.875001 0.625000 0.250000 Ca\n0.625001 0.875000 0.749999 Ca\n0.875000 0.749999 0.624999 Ca\n0.625000 0.249999 0.875000 Ca\n0.750001 0.625000 0.875000 Ca\n0.750001 0.125000 0.375000 Ca\n0.250001 0.375000 0.125000 Ca\n0.250000 0.875000 0.624999 Ca\n0.375000 0.749999 0.125000 Ca\n0.125000 0.249999 0.374999 Ca\n0.375001 0.125000 0.250000 Ca\n0.125000 0.375000 0.750000 Ca\n0.000000 0.500000 0.500000 Mn\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 1.000000 Mn\n0.500000 -0.000000 0.500000 Mn\n0.500000 -0.000000 1.000000 Mn\n0.000000 0.000000 0.500001 Mn\n0.000000 0.500000 1.000000 Mn\n0.500000 0.500000 0.500000 Mn\n0.250001 0.125000 0.875001 Si\n0.625000 0.749999 0.375000 Si\n0.250000 0.625000 0.374999 Si\n0.375001 0.625000 0.750000 Si\n0.875001 0.125000 0.750000 Si\n0.750001 0.375000 0.625000 Si\n0.125000 0.749999 0.875000 Si\n0.625001 0.375000 0.250000 Si\n0.375000 0.249999 0.625000 Si\n0.750001 0.875000 0.125000 Si\n0.125000 0.875000 0.250000 Si\n0.875000 0.249999 0.125000 Si\n0.194251 0.204795 0.588431 O\n0.795205 0.411569 0.805749 O\n0.010545 0.305749 0.894181 O\n0.116364 0.605820 0.911569 O\n0.204795 0.588431 0.194251 O\n0.204796 0.116364 0.010545 O\n0.588431 0.194251 0.204795 O\n0.605820 0.194251 0.489456 O\n0.704796 0.694250 0.088431 O\n0.911570 0.295205 0.305749 O\n0.805750 0.795205 0.411569 O\n0.105820 0.616363 0.411569 O\n0.694251 0.088431 0.704795 O\n0.088432 0.704795 0.694251 O\n0.989456 0.795205 0.883635 O\n0.805750 0.510545 0.394180 O\n0.411569 0.105820 0.616364 O\n0.394181 0.805749 0.510544 O\n0.883636 0.989455 0.795204 O\n0.616364 0.411569 0.105820 O\n0.105820 0.989455 0.694251 O\n0.394180 0.088431 0.883636 O\n0.088432 0.883636 0.394180 O\n0.510544 0.616363 0.704795 O\n0.616364 0.704795 0.510544 O\n0.694251 0.105820 0.989455 O\n0.510544 0.394180 0.805749 O\n0.305749 0.911568 0.295204 O\n0.411570 0.805749 0.795205 O\n0.295205 0.489455 0.383635 O\n0.010545 0.204795 0.116364 O\n0.194251 0.489455 0.605819 O\n0.588431 0.894180 0.383635 O\n0.116364 0.010545 0.204795 O\n0.489456 0.605820 0.194251 O\n0.383636 0.588431 0.894180 O\n0.894181 0.010545 0.305749 O\n0.795205 0.883636 0.989455 O\n0.605820 0.911568 0.116363 O\n0.489456 0.383636 0.295204 O\n0.383637 0.295205 0.489455 O\n0.305750 0.894180 0.010544 O\n0.295205 0.305749 0.911569 O\n0.704796 0.510545 0.616363 O\n0.989456 0.694250 0.105819 O\n0.883636 0.394180 0.088430 O\n0.911570 0.116364 0.605820 O\n0.894180 0.383636 0.588431 O\n",
"nsites": 80,
"nelements": 4,
"elements": [
"Ca",
"Mn",
"Si",
"O"
],
"chemical_system": "Ca-Mn-O-Si",
"density": 3.793763020080778,
"density_atomic": 0.09023857511521388,
"volume": 886.5388210957278,
"volume_molar": 6.673576962303662,
"formula_full": "Ca12 Mn8 Si12 O48",
"formula_reduced": "Ca3Mn2(SiO4)3",
"formula_anonymous": "A2B3C3D12",
"energy_above_hull": 2.732894177137931,
"spacegroup": 230
},
{
"id": "jvasp-18041",
"created_at": "2022-09-04T14:37:29.127965Z",
"updated_at": "2022-09-04T14:37:29.127998Z",
"structure_string": "Mn3 Ga1 C1\n1.0\n3.812317 0.000000 -0.000000\n0.000000 3.812317 -0.000000\n0.000000 0.000000 3.812317\nMn Ga C\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Mn\n0.500000 0.500000 0.000000 Mn\n0.500000 0.000000 0.500000 Mn\n0.000000 0.000000 0.000000 Ga\n0.500000 0.500000 0.500000 C\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Mn",
"Ga",
"C"
],
"chemical_system": "C-Ga-Mn",
"density": 7.388959285747912,
"density_atomic": 0.09024081047813769,
"volume": 55.407303785368065,
"volume_molar": 6.673411650551346,
"formula_full": "Mn3 Ga1 C1",
"formula_reduced": "Mn3GaC",
"formula_anonymous": "ABC3",
"energy_above_hull": 3.8815808098275855,
"spacegroup": 221
},
{
"id": "jvasp-71493",
"created_at": "2022-09-04T14:36:20.873901Z",
"updated_at": "2022-09-04T14:36:20.873923Z",
"structure_string": "Be2 Pd1 Ru1\n1.0\n2.800775 0.000000 -0.000000\n0.000000 2.800775 -0.000000\n-0.000000 -0.000000 5.650390\nBe Pd Ru\n2 1 1\ndirect\n0.000000 0.000000 0.737760 Be\n0.000000 0.000000 0.262240 Be\n0.499999 0.499999 0.000000 Pd\n0.499999 0.499999 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Be",
"Pd",
"Ru"
],
"chemical_system": "Be-Pd-Ru",
"density": 8.448671798545167,
"density_atomic": 0.09024541039605632,
"volume": 44.32358368636548,
"volume_molar": 6.673071498673316,
"formula_full": "Be2 Pd1 Ru1",
"formula_reduced": "Be2PdRu",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3611421,
"spacegroup": 123
},
{
"id": "jvasp-90056",
"created_at": "2022-09-04T14:35:50.233750Z",
"updated_at": "2022-09-04T14:35:50.233767Z",
"structure_string": "Fe3 Ni3 P3\n1.0\n0.000000 0.000000 -3.422925\n-2.900057 -5.023045 0.000000\n-2.900161 5.023106 0.000000\nFe Ni P\n3 3 3\ndirect\n0.499999 0.600512 0.000001 Fe\n0.499999 0.399481 0.399452 Fe\n0.499999 0.000030 0.600549 Fe\n0.000000 0.258359 0.000000 Ni\n0.000000 0.741592 0.741599 Ni\n0.000000 -0.000006 0.258402 Ni\n0.000000 0.333312 0.666670 P\n0.000000 0.666642 0.333331 P\n0.499999 -0.000025 -0.000000 P\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Fe",
"Ni",
"P"
],
"chemical_system": "Fe-Ni-P",
"density": 7.26872502125941,
"density_atomic": 0.09024665286510954,
"volume": 99.72669029013386,
"volume_molar": 6.672979627290126,
"formula_full": "Fe3 Ni3 P3",
"formula_reduced": "FeNiP",
"formula_anonymous": "ABC",
"energy_above_hull": 2.060314466666666,
"spacegroup": 189
},
{
"id": "jvasp-51344",
"created_at": "2022-09-04T14:37:06.283822Z",
"updated_at": "2022-09-04T14:37:06.283850Z",
"structure_string": "Na1 H1 F2\n1.0\n3.089878 -0.097234 -0.024849\n0.151704 3.227211 -0.359804\n0.562427 -0.159407 4.449492\nNa H F\n1 1 2\ndirect\n0.011662 0.782222 0.301867 Na\n0.499390 0.080123 0.883699 H\n0.437616 0.882721 0.682746 F\n0.550531 0.265666 0.139438 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"H",
"F"
],
"chemical_system": "F-H-Na",
"density": 2.3226071981166023,
"density_atomic": 0.09024712801550847,
"volume": 44.322740102184994,
"volume_molar": 6.672944494106371,
"formula_full": "Na1 H1 F2",
"formula_reduced": "NaHF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.018475,
"spacegroup": 1
},
{
"id": "jvasp-70164",
"created_at": "2022-09-04T14:36:11.324163Z",
"updated_at": "2022-09-04T14:36:11.324180Z",
"structure_string": "Li1 Ti1 Be2\n1.0\n-1.986016 1.986016 2.809244\n1.986016 -1.986016 2.809244\n1.986016 1.986016 -2.809244\nLi Ti Be\n1 1 2\ndirect\n0.499999 0.499999 0.000000 Li\n0.750001 0.250000 0.500001 Ti\n0.000000 0.000000 0.000000 Be\n0.250000 0.750001 0.500001 Be\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ti",
"Be"
],
"chemical_system": "Be-Li-Ti",
"density": 2.7287174283270814,
"density_atomic": 0.09024955144023442,
"volume": 44.32154992647142,
"volume_molar": 6.672765308964464,
"formula_full": "Li1 Ti1 Be2",
"formula_reduced": "LiTiBe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.073602633333333,
"spacegroup": 216
},
{
"id": "jvasp-42759",
"created_at": "2022-09-04T14:37:30.347230Z",
"updated_at": "2022-09-04T14:37:30.347249Z",
"structure_string": "V8 O8 F8\n1.0\n4.657675 -0.005562 -0.000165\n-0.005562 4.657501 -0.000121\n-0.000529 -0.000418 12.258574\nV O F\n8 8 8\ndirect\n0.971379 0.965097 0.999900 V\n0.034902 0.028625 0.250099 V\n0.986826 0.949169 0.500222 V\n0.050829 0.013173 0.749780 V\n0.535846 0.464154 0.125000 V\n0.478901 0.521101 0.625000 V\n0.476110 0.525099 0.875027 V\n0.474903 0.523890 0.374975 V\n0.818867 0.181138 0.125000 O\n0.686336 0.688942 0.500225 O\n0.689771 0.681192 0.999892 O\n0.311062 0.313660 0.749775 O\n0.318813 0.310226 0.250108 O\n0.191184 0.808813 0.624999 O\n0.188433 0.808835 0.376161 O\n0.191160 0.811563 0.873841 O\n0.211048 0.788949 0.125000 F\n0.297247 0.287651 0.999874 F\n0.279758 0.299613 0.500272 F\n0.712347 0.702756 0.250127 F\n0.700385 0.720244 0.749728 F\n0.798649 0.203450 0.374987 F\n0.798706 0.201299 0.625000 F\n0.796553 0.201354 0.875012 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"V",
"O",
"F"
],
"chemical_system": "F-O-V",
"density": 4.293084549312817,
"density_atomic": 0.09025053205042993,
"volume": 265.9264101245337,
"volume_molar": 6.672692806547628,
"formula_full": "V8 O8 F8",
"formula_reduced": "VOF",
"formula_anonymous": "ABC",
"energy_above_hull": 1.058892660833333,
"spacegroup": 5
},
{
"id": "jvasp-98801",
"created_at": "2022-09-04T14:35:49.560925Z",
"updated_at": "2022-09-04T14:35:49.560951Z",
"structure_string": "V4 Cd2 P4 O20\n1.0\n6.629686 0.040839 -1.477299\n-3.406443 5.687754 -1.477299\n-0.001115 -0.001982 8.783906\nV Cd P O\n4 2 4 20\ndirect\n0.088395 0.363835 0.737122 V\n0.613836 0.838393 0.237122 V\n0.626714 0.351272 0.262879 V\n0.601273 0.376713 0.762879 V\n0.998826 0.998824 -0.000000 Cd\n0.248825 0.748824 0.500000 Cd\n0.785900 0.786214 0.583764 P\n0.036214 0.535898 0.083764 P\n0.202451 0.202135 0.416236 P\n0.452136 0.952450 0.916236 P\n0.278945 0.751691 0.193411 O\n0.965152 0.986484 0.297830 O\n0.637687 0.917531 0.029067 O\n0.575814 0.571732 0.164488 O\n0.917322 0.438654 0.202170 O\n0.382951 0.097197 0.034467 O\n0.598485 0.812730 0.465533 O\n0.407246 0.411325 0.835513 O\n0.335533 0.308280 0.306589 O\n0.688656 0.667321 0.702170 O\n0.062731 0.348484 0.965534 O\n0.821734 0.325813 0.664488 O\n0.558281 0.085533 0.806589 O\n0.167532 0.387686 0.529068 O\n0.001692 0.028944 0.693412 O\n0.858620 0.638464 0.470933 O\n0.888466 0.608619 0.970933 O\n0.347198 0.132951 0.534467 O\n0.661326 0.157245 0.335512 O\n0.236486 0.715151 0.797831 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"V",
"Cd",
"P",
"O"
],
"chemical_system": "Cd-O-P-V",
"density": 4.358428562749474,
"density_atomic": 0.09025080098595635,
"volume": 332.40702212347355,
"volume_molar": 6.672672922799972,
"formula_full": "V4 Cd2 P4 O20",
"formula_reduced": "V2Cd(PO5)2",
"formula_anonymous": "AB2C2D10",
"energy_above_hull": 2.9021236099999994,
"spacegroup": 43
},
{
"id": "jvasp-12106",
"created_at": "2022-09-04T14:35:54.212479Z",
"updated_at": "2022-09-04T14:35:54.212514Z",
"structure_string": "V2 Cu2 O8\n1.0\n4.857114 -0.163244 -2.886044\n-1.933171 4.752963 -2.370581\n0.109704 0.163244 5.648786\nV Cu O\n2 2 8\ndirect\n0.712564 0.462565 0.250000 V\n0.287433 0.537434 0.750000 V\n0.500000 -0.000000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.234140 0.790534 0.056392 O\n0.177696 0.668985 0.508712 O\n0.822302 0.331013 0.491290 O\n0.339726 0.331013 0.008711 O\n0.765857 0.822251 0.556393 O\n0.765858 0.209465 0.943609 O\n0.660273 0.668985 0.991289 O\n0.234141 0.177748 0.443607 O\n",
"nsites": 12,
"nelements": 3,
"elements": [
"V",
"Cu",
"O"
],
"chemical_system": "Cu-O-V",
"density": 4.458167152370975,
"density_atomic": 0.09025193744171713,
"volume": 132.96113457674366,
"volume_molar": 6.672588900253778,
"formula_full": "V2 Cu2 O8",
"formula_reduced": "VCuO4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.243336441666667,
"spacegroup": 74
},
{
"id": "jvasp-119712",
"created_at": "2022-09-04T14:38:36.861464Z",
"updated_at": "2022-09-04T14:38:36.861484Z",
"structure_string": "V4 Cd2 P4 O20\n1.0\n8.574641 -0.015232 4.878680\n6.405753 5.697762 1.913549\n0.001541 -0.004059 6.792228\nV Cd P O\n4 2 4 20\ndirect\n0.636170 0.626689 0.088414 V\n0.161586 0.601273 0.613830 V\n0.648727 0.088414 0.626689 V\n0.623311 0.613830 0.601273 V\n0.001208 0.998792 0.998793 Cd\n0.251208 0.248792 0.248792 Cd\n0.213786 0.202450 0.785900 P\n0.464100 0.452136 0.036215 P\n0.797864 0.785899 0.202451 P\n0.047549 0.036214 0.452136 P\n0.248305 0.558289 0.278937 O\n0.013515 0.688649 0.965155 O\n0.082464 0.888460 0.637688 O\n0.428252 0.407261 0.575811 O\n0.561350 0.236484 0.917320 O\n0.902785 0.062752 0.382954 O\n0.187248 0.347215 0.598492 O\n0.588674 0.575811 0.407262 O\n0.691710 0.001695 0.335532 O\n0.332681 0.965154 0.688650 O\n0.651508 0.382953 0.062752 O\n0.674189 0.661325 0.821748 O\n0.914468 0.278937 0.558290 O\n0.612312 0.858611 0.167537 O\n0.971063 0.335532 0.001695 O\n0.361540 0.167536 0.858611 O\n0.391389 0.637687 0.888460 O\n0.867046 0.598492 0.347215 O\n0.842738 0.821748 0.661326 O\n0.284845 0.917319 0.236485 O\n",
"nsites": 30,
"nelements": 4,
"elements": [
"V",
"Cd",
"P",
"O"
],
"chemical_system": "Cd-O-P-V",
"density": 4.3584880539527955,
"density_atomic": 0.09025203288150634,
"volume": 332.40248493225175,
"volume_molar": 6.67258184411933,
"formula_full": "V4 Cd2 P4 O20",
"formula_reduced": "V2Cd(PO5)2",
"formula_anonymous": "AB2C2D10",
"energy_above_hull": 2.9021229433333326,
"spacegroup": 43
},
{
"id": "jvasp-119170",
"created_at": "2022-09-04T14:38:36.144901Z",
"updated_at": "2022-09-04T14:38:36.144927Z",
"structure_string": "Mg1 Cd3 C4 O12\n1.0\n4.765047 -0.012372 9.910251\n2.248938 4.200965 9.910251\n-0.020718 -0.012372 10.996287\nMg Cd C O\n1 3 4 12\ndirect\n0.500000 0.500001 0.499999 Mg\n0.000000 0.000000 0.000000 Cd\n0.754735 0.754736 0.754734 Cd\n0.245265 0.245266 0.245265 Cd\n0.870833 0.870835 0.870832 C\n0.376725 0.376726 0.376725 C\n0.129167 0.129167 0.129167 C\n0.623274 0.623276 0.623273 C\n0.361464 0.889887 0.618532 O\n0.848528 0.374301 0.164101 O\n0.889886 0.618535 0.361463 O\n0.374300 0.164103 0.848527 O\n0.638536 0.110115 0.381466 O\n0.381467 0.638537 0.110113 O\n0.110114 0.381468 0.638535 O\n0.625700 0.835899 0.151471 O\n0.164102 0.848529 0.374300 O\n0.835898 0.151473 0.625699 O\n0.151472 0.625701 0.835897 O\n0.618533 0.361466 0.889885 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Mg",
"Cd",
"C",
"O"
],
"chemical_system": "C-Cd-Mg-O",
"density": 4.5078163095018065,
"density_atomic": 0.09025231275250419,
"volume": 221.6009694382604,
"volume_molar": 6.672561152548311,
"formula_full": "Mg1 Cd3 C4 O12",
"formula_reduced": "MgCd3(CO3)4",
"formula_anonymous": "AB3C4D12",
"energy_above_hull": 2.858323515,
"spacegroup": 148
}
]
}