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=513",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=511",
"results": [
{
"id": "jvasp-44330",
"created_at": "2022-09-04T14:36:19.461006Z",
"updated_at": "2022-09-04T14:36:19.461033Z",
"structure_string": "Li8 Fe2 O6 F2\n1.0\n3.963512 3.589931 0.000000\n-3.963512 3.589931 0.000000\n0.000000 0.000000 6.349226\nLi Fe O F\n8 2 6 2\ndirect\n0.168469 0.841555 0.498027 Li\n0.158445 0.831531 0.998028 Li\n0.580143 0.885005 0.238155 Li\n0.114995 0.419856 0.738155 Li\n0.419856 0.114995 0.738155 Li\n0.885005 0.580143 0.238155 Li\n0.831531 0.158445 0.998028 Li\n0.841555 0.168469 0.498027 Li\n0.645392 0.645392 0.777189 Fe\n0.354607 0.354607 0.277189 Fe\n0.261746 0.678329 0.250068 O\n0.321670 0.738254 0.750068 O\n0.798864 0.798864 0.011695 O\n0.201136 0.201136 0.511695 O\n0.738254 0.321670 0.750068 O\n0.678329 0.261746 0.250068 O\n0.204170 0.204170 0.988619 F\n0.795829 0.795829 0.488619 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-Li-O",
"density": 2.7682363210024548,
"density_atomic": 0.099622043205655,
"volume": 180.6829033092772,
"volume_molar": 6.044988203632984,
"formula_full": "Li8 Fe2 O6 F2",
"formula_reduced": "Li4FeO3F",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.5151795869444442,
"spacegroup": 36
},
{
"id": "jvasp-46255",
"created_at": "2022-09-04T14:38:05.353549Z",
"updated_at": "2022-09-04T14:38:05.353570Z",
"structure_string": "Li6 Cr2 Cl2 O8\n1.0\n6.732671 0.000000 0.000000\n0.000000 6.732671 -0.000000\n0.000000 -0.000000 4.790677\nLi Cr Cl O\n6 2 2 8\ndirect\n0.500000 0.000000 0.156735 Li\n0.750000 0.250000 0.500000 Li\n0.250000 0.250000 0.500000 Li\n0.000000 0.500000 0.843265 Li\n0.250000 0.750000 0.500000 Li\n0.750000 0.750000 0.500000 Li\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 0.000000 Cr\n0.000000 0.500000 0.321640 Cl\n0.500000 0.000000 0.678360 Cl\n0.196562 0.000000 0.210698 O\n0.803438 0.000000 0.210698 O\n0.000000 0.196562 0.789303 O\n0.500000 0.303438 0.210698 O\n0.303438 0.500000 0.789303 O\n0.696562 0.500000 0.789303 O\n0.500000 0.696562 0.210698 O\n0.000000 0.803438 0.789303 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Cl",
"O"
],
"chemical_system": "Cl-Cr-Li-O",
"density": 2.6346098709099235,
"density_atomic": 0.08288974988758407,
"volume": 217.15592126181807,
"volume_molar": 7.265241803923029,
"formula_full": "Li6 Cr2 Cl2 O8",
"formula_reduced": "Li3CrClO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.9469172741666676,
"spacegroup": 129
},
{
"id": "jvasp-34668",
"created_at": "2022-09-04T14:38:04.829194Z",
"updated_at": "2022-09-04T14:38:04.829205Z",
"structure_string": "K6 S2 O8 F2\n1.0\n6.304529 0.000000 -3.517155\n-1.962142 5.991417 -3.517155\n0.034505 0.047607 7.470887\nK S O F\n6 2 8 2\ndirect\n0.188508 0.688508 0.000001 K\n0.250000 0.250000 0.500001 K\n0.688508 0.811492 0.000001 K\n0.811492 0.311492 0.000001 K\n0.311492 0.188508 0.000000 K\n0.750000 0.750001 0.500002 K\n0.750000 0.250000 0.500001 S\n0.250000 0.750001 0.500001 S\n0.711196 0.448065 0.659261 O\n0.948064 0.211196 0.659261 O\n0.551936 0.051936 0.340740 O\n0.051936 0.788804 0.340741 O\n0.288804 0.551936 0.340741 O\n0.788804 0.288804 0.340741 O\n0.448064 0.948065 0.659262 O\n0.211196 0.711197 0.659261 O\n0.000000 0.000000 0.000000 F\n0.500000 0.500000 0.000001 F\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"S",
"O",
"F"
],
"chemical_system": "F-K-O-S",
"density": 2.7141966886873607,
"density_atomic": 0.06331126888161104,
"volume": 284.30957581436434,
"volume_molar": 9.511957138722186,
"formula_full": "K6 S2 O8 F2",
"formula_reduced": "K3SO4F",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.8857042536111115,
"spacegroup": 140
},
{
"id": "jvasp-122531",
"created_at": "2022-09-04T14:38:51.026999Z",
"updated_at": "2022-09-04T14:38:51.027029Z",
"structure_string": "Li6 Cr2 Cl2 O8\n1.0\n6.734423 -0.000000 0.000000\n0.000000 6.734423 0.000000\n-0.000000 -0.000000 4.789999\nLi Cr Cl O\n6 2 2 8\ndirect\n0.500000 0.000000 0.156141 Li\n0.750000 0.250000 0.500000 Li\n0.250000 0.250000 0.500000 Li\n-0.000000 0.500000 0.843859 Li\n0.250000 0.750000 0.500000 Li\n0.750000 0.750000 0.500000 Li\n0.000000 0.000000 0.000000 Cr\n0.500000 0.500000 -0.000000 Cr\n-0.000000 0.500000 0.322447 Cl\n0.500000 0.000000 0.677553 Cl\n0.196453 0.000000 0.210373 O\n0.803547 0.000000 0.210373 O\n-0.000000 0.196453 0.789627 O\n0.500000 0.303547 0.210373 O\n0.303547 0.500000 0.789627 O\n0.696452 0.500000 0.789627 O\n0.500000 0.696452 0.210373 O\n-0.000000 0.803547 0.789627 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Cr",
"Cl",
"O"
],
"chemical_system": "Cl-Cr-Li-O",
"density": 2.6336119521447383,
"density_atomic": 0.08285835349840037,
"volume": 217.23820520217674,
"volume_molar": 7.267994723207069,
"formula_full": "Li6 Cr2 Cl2 O8",
"formula_reduced": "Li3CrClO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.943816163055556,
"spacegroup": 129
},
{
"id": "jvasp-95283",
"created_at": "2022-09-04T14:35:57.026841Z",
"updated_at": "2022-09-04T14:35:57.026861Z",
"structure_string": "Sr4 Li4 Al12 N16\n1.0\n5.717118 -0.001366 1.340049\n1.200422 7.369480 0.835193\n-0.006210 -0.002375 9.974598\nSr Li Al N\n4 4 12 16\ndirect\n0.995724 0.866154 0.872598 Sr\n0.004276 0.133846 0.127402 Sr\n0.976795 0.615860 0.628439 Sr\n0.023204 0.384141 0.371561 Sr\n0.533362 0.674879 0.887140 Li\n0.466638 0.325121 0.112860 Li\n0.791900 0.818745 0.355312 Li\n0.208100 0.181255 0.644688 Li\n0.562214 0.202468 0.367210 Al\n0.437786 0.797532 0.632790 Al\n0.531141 0.438707 0.624727 Al\n0.819770 0.556838 0.100107 Al\n0.180230 0.443162 0.899893 Al\n0.468859 0.561293 0.375273 Al\n0.831215 0.292382 0.852616 Al\n0.174590 0.940250 0.398008 Al\n0.825410 0.059750 0.601992 Al\n0.552377 0.954301 0.123506 Al\n0.447623 0.045699 0.876494 Al\n0.168785 0.707618 0.147384 Al\n0.196979 0.708733 0.332952 N\n0.803021 0.291267 0.667048 N\n0.161894 0.475495 0.089226 N\n0.838106 0.524505 0.910774 N\n0.830917 0.795059 0.144375 N\n0.169083 0.204941 0.855625 N\n0.152210 0.932361 0.592446 N\n0.616759 0.916373 0.720692 N\n0.383241 0.083627 0.279308 N\n0.372601 0.354888 0.504728 N\n0.627399 0.645113 0.495272 N\n0.349928 0.866806 0.028024 N\n0.650072 0.133194 0.971976 N\n0.342582 0.591440 0.761618 N\n0.847790 0.067639 0.407554 N\n0.657418 0.408560 0.238382 N\n",
"nsites": 36,
"nelements": 4,
"elements": [
"Sr",
"Li",
"Al",
"N"
],
"chemical_system": "Al-Li-N-Sr",
"density": 3.65867170464208,
"density_atomic": 0.08564559886062445,
"volume": 420.3368355049356,
"volume_molar": 7.031465527843578,
"formula_full": "Sr4 Li4 Al12 N16",
"formula_reduced": "SrLiAl3N4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 3.239366412222222,
"spacegroup": 2
},
{
"id": "jvasp-107884",
"created_at": "2022-09-04T14:35:55.658915Z",
"updated_at": "2022-09-04T14:35:55.658942Z",
"structure_string": "Zn1 Ga1 Cu3 Se4\n1.0\n5.758491 0.000000 0.000000\n0.000000 5.758491 0.000000\n0.000000 0.000000 5.758491\nZn Ga Cu Se\n1 1 3 4\ndirect\n0.500000 0.500000 0.500000 Zn\n0.000000 0.000000 0.000000 Ga\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.252401 0.252401 0.252401 Se\n0.747599 0.747599 0.252401 Se\n0.252401 0.747599 0.747599 Se\n0.747599 0.252401 0.747599 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Zn",
"Ga",
"Cu",
"Se"
],
"chemical_system": "Cu-Ga-Se-Zn",
"density": 5.579485385825565,
"density_atomic": 0.04713206112135793,
"volume": 190.95282034932362,
"volume_molar": 12.777164029584657,
"formula_full": "Zn1 Ga1 Cu3 Se4",
"formula_reduced": "ZnGaCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.2762197268518517,
"spacegroup": 215
},
{
"id": "jvasp-57137",
"created_at": "2022-09-04T14:38:34.165360Z",
"updated_at": "2022-09-04T14:38:34.165393Z",
"structure_string": "K6 Li2 Ir2 O8\n1.0\n5.772843 0.022965 1.071565\n1.203958 7.087611 0.723115\n0.025122 0.018713 7.225348\nK Li Ir O\n6 2 2 8\ndirect\n0.977441 0.934050 0.756031 K\n0.750000 0.404127 0.595874 K\n0.477441 0.756029 0.934052 K\n0.522559 0.243970 0.065950 K\n0.022559 0.065949 0.243970 K\n0.250000 0.595872 0.404128 K\n0.250000 0.269436 0.730564 Li\n0.750000 0.730562 0.269438 Li\n0.500000 -0.000001 0.500001 Ir\n0.000000 0.500000 0.000000 Ir\n0.760831 0.793468 0.518882 O\n0.529709 0.088082 0.736904 O\n0.260831 0.518880 0.793470 O\n0.029709 0.736903 0.088083 O\n0.470291 0.911916 0.263098 O\n0.970290 0.263096 0.911918 O\n0.739168 0.481118 0.206532 O\n0.239168 0.206531 0.481120 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Li",
"Ir",
"O"
],
"chemical_system": "Ir-K-Li-O",
"density": 4.280374793969493,
"density_atomic": 0.06097854404547621,
"volume": 295.18579496709646,
"volume_molar": 9.87583559802419,
"formula_full": "K6 Li2 Ir2 O8",
"formula_reduced": "K3LiIrO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.4311098999999998,
"spacegroup": 15
},
{
"id": "jvasp-24241",
"created_at": "2022-09-04T14:38:32.418633Z",
"updated_at": "2022-09-04T14:38:32.418650Z",
"structure_string": "K2 Li6 Pb2 O8\n1.0\n-5.945894 0.011567 -0.008287\n-0.178532 -5.976161 0.032738\n2.154909 1.967301 6.315576\nK Li Pb O\n2 6 2 8\ndirect\n0.510631 0.990885 0.250460 K\n0.489368 0.009115 0.749540 K\n0.051394 0.126934 0.906605 Li\n0.948605 0.873066 0.093395 Li\n0.681883 0.459196 0.153802 Li\n0.064498 0.165351 0.447043 Li\n0.935501 0.834649 0.552957 Li\n0.318116 0.540804 0.846199 Li\n0.241314 0.494525 0.295033 Pb\n0.758685 0.505475 0.704968 Pb\n0.359504 0.361582 0.566709 O\n0.879754 0.168000 0.633405 O\n0.120245 0.832000 0.366595 O\n0.656097 0.673791 0.973183 O\n0.343902 0.326209 0.026818 O\n0.065461 0.769228 0.835324 O\n0.934538 0.230772 0.164676 O\n0.640495 0.638418 0.433292 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"K",
"Li",
"Pb",
"O"
],
"chemical_system": "K-Li-O-Pb",
"density": 4.893775042350554,
"density_atomic": 0.08010385981197415,
"volume": 224.7082730126983,
"volume_molar": 7.51791583343877,
"formula_full": "K2 Li6 Pb2 O8",
"formula_reduced": "KLi3PbO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.2604636466666663,
"spacegroup": 2
},
{
"id": "jvasp-62733",
"created_at": "2022-09-04T14:35:45.454643Z",
"updated_at": "2022-09-04T14:35:45.454653Z",
"structure_string": "B4 Pb12 O16 F4\n1.0\n6.501188 0.000000 0.000000\n-0.000000 7.683158 0.000000\n0.000000 0.000000 12.110200\nB Pb O F\n4 12 16 4\ndirect\n0.250000 0.978322 0.500000 B\n0.750000 0.021678 0.000000 B\n0.750000 0.021678 0.500000 B\n0.250000 0.978322 0.000000 B\n0.450762 0.891647 0.750000 Pb\n0.549238 0.108353 0.250000 Pb\n0.950763 0.108353 0.750000 Pb\n0.049238 0.891647 0.250000 Pb\n0.470564 0.333071 0.895031 Pb\n0.529436 0.666929 0.395031 Pb\n0.970565 0.666929 0.604969 Pb\n0.470564 0.333071 0.604969 Pb\n0.529436 0.666929 0.104969 Pb\n0.970565 0.666929 0.895031 Pb\n0.029436 0.333071 0.395031 Pb\n0.029436 0.333071 0.104969 Pb\n0.203405 0.067813 0.096361 O\n0.750000 0.202666 0.000000 O\n0.250000 0.797334 0.500000 O\n0.250000 0.797334 0.000000 O\n0.750000 0.202666 0.500000 O\n0.703405 0.932187 0.403639 O\n0.296595 0.067813 0.903639 O\n0.796595 0.932187 0.596361 O\n0.090068 0.806360 0.750000 O\n0.703405 0.932187 0.096361 O\n0.796595 0.932187 0.903639 O\n0.203405 0.067813 0.403639 O\n0.590068 0.193640 0.750000 O\n0.409932 0.806360 0.250000 O\n0.909932 0.193640 0.250000 O\n0.296595 0.067813 0.596361 O\n0.804906 0.578113 0.250000 F\n0.304906 0.421887 0.250000 F\n0.695094 0.578113 0.750000 F\n0.195094 0.421887 0.750000 F\n",
"nsites": 36,
"nelements": 4,
"elements": [
"B",
"Pb",
"O",
"F"
],
"chemical_system": "B-F-O-Pb",
"density": 7.855583893834854,
"density_atomic": 0.05951393904290164,
"volume": 604.9003070364538,
"volume_molar": 10.1188744298354,
"formula_full": "B4 Pb12 O16 F4",
"formula_reduced": "BPb3O4F",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.7278510362037038,
"spacegroup": 57
},
{
"id": "jvasp-57409",
"created_at": "2022-09-04T14:38:33.381151Z",
"updated_at": "2022-09-04T14:38:33.381177Z",
"structure_string": "Cr2 Ag6 Cl2 O8\n1.0\n5.305908 0.000000 0.000000\n0.000000 7.364233 0.000000\n0.000000 0.000000 7.364171\nCr Ag Cl O\n2 6 2 8\ndirect\n0.999978 0.000000 0.000000 Cr\n0.000022 0.500000 0.500000 Cr\n0.109104 0.500000 0.000000 Ag\n0.500000 0.750000 0.250000 Ag\n0.500000 0.250000 0.250000 Ag\n0.890897 0.000000 0.500000 Ag\n0.500000 0.250000 0.750000 Ag\n0.500000 0.750000 0.750000 Ag\n0.635679 0.500000 0.000000 Cl\n0.364321 0.000000 0.500000 Cl\n0.189489 0.816958 0.000000 O\n0.189548 0.500000 0.683037 O\n0.189489 0.183041 0.000000 O\n0.189548 0.500000 0.316963 O\n0.810453 0.000000 0.183037 O\n0.810511 0.683041 0.500000 O\n0.810511 0.316959 0.500000 O\n0.810453 0.000000 0.816963 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Cr",
"Ag",
"Cl",
"O"
],
"chemical_system": "Ag-Cl-Cr-O",
"density": 5.482876999845482,
"density_atomic": 0.06255491010512312,
"volume": 287.7471963392021,
"volume_molar": 9.626967331389066,
"formula_full": "Cr2 Ag6 Cl2 O8",
"formula_reduced": "CrAg3ClO4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 1.6889352497222228,
"spacegroup": 129
},
{
"id": "jvasp-111243",
"created_at": "2022-09-04T14:38:46.224302Z",
"updated_at": "2022-09-04T14:38:46.224324Z",
"structure_string": "Al1 Cd1 Cu3 Se4\n1.0\n5.860010 0.000000 0.000000\n0.000000 5.860010 0.000000\n-0.000000 -0.000000 5.860010\nAl Cd Cu Se\n1 1 3 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 Cd\n-0.000000 0.500000 -0.000000 Cu\n0.000000 0.000000 0.500000 Cu\n0.500000 0.000000 -0.000000 Cu\n0.238422 0.238422 0.238422 Se\n0.761578 0.761578 0.238422 Se\n0.238422 0.761578 0.761578 Se\n0.761578 0.238422 0.761578 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Al",
"Cd",
"Cu",
"Se"
],
"chemical_system": "Al-Cd-Cu-Se",
"density": 5.329659952736813,
"density_atomic": 0.044724700196236734,
"volume": 201.23108618975797,
"volume_molar": 13.464910292471274,
"formula_full": "Al1 Cd1 Cu3 Se4",
"formula_reduced": "AlCdCu3Se4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.5031908185185182,
"spacegroup": 215
},
{
"id": "jvasp-110950",
"created_at": "2022-09-04T14:38:37.388250Z",
"updated_at": "2022-09-04T14:38:37.388264Z",
"structure_string": "Zn1 In3 As1 Se4\n1.0\n5.357339 -0.008737 2.391064\n2.645693 6.561758 1.225675\n-0.006884 -0.007961 7.218725\nZn In As Se\n1 3 1 4\ndirect\n0.978844 0.009681 0.002028 Zn\n0.401141 0.392016 0.804956 In\n0.613808 0.598803 0.194922 In\n0.807308 0.802148 0.597876 In\n0.421076 0.719609 0.904750 As\n0.622309 0.930838 0.300695 Se\n0.891923 0.108494 0.680971 Se\n0.062131 0.273176 0.126516 Se\n0.251464 0.465234 0.487283 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Zn",
"In",
"As",
"Se"
],
"chemical_system": "As-In-Se-Zn",
"density": 5.233287963215026,
"density_atomic": 0.0354273864264065,
"volume": 254.04075512868408,
"volume_molar": 16.998546512906973,
"formula_full": "Zn1 In3 As1 Se4",
"formula_reduced": "ZnIn3AsSe4",
"formula_anonymous": "ABC3D4",
"energy_above_hull": 0.577849502962963,
"spacegroup": 1
}
]
}