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=9",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=7",
"results": [
{
"id": "jvasp-56689",
"created_at": "2022-09-04T14:37:06.968210Z",
"updated_at": "2022-09-04T14:37:06.968238Z",
"structure_string": "K2 Mo2 P2 Cl2 O10\n1.0\n6.486858 0.000000 0.000000\n0.000000 6.486858 -0.000000\n0.000000 0.000000 7.269173\nK Mo P Cl O\n2 2 2 2 10\ndirect\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.500000 K\n0.000000 0.500000 0.098244 Mo\n0.500000 0.000000 0.901755 Mo\n0.000000 0.000000 0.000000 P\n0.500000 0.500000 0.000000 P\n0.500000 0.000000 0.545870 Cl\n0.000000 0.500000 0.454129 Cl\n0.812294 0.000000 0.869159 O\n0.500000 0.687706 0.869159 O\n0.687706 0.500000 0.130841 O\n0.312294 0.500000 0.130841 O\n0.000000 0.812294 0.130841 O\n0.187706 0.000000 0.869159 O\n0.500000 0.312294 0.869159 O\n0.000000 0.500000 0.868522 O\n0.500000 0.000000 0.131478 O\n0.000000 0.187706 0.130841 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"K",
"Mo",
"P",
"Cl",
"O"
],
"chemical_system": "Cl-K-Mo-O-P",
"density": 3.0559424481733086,
"density_atomic": 0.05884623990762427,
"volume": 305.8819055942413,
"volume_molar": 10.233688285697516,
"formula_full": "K2 Mo2 P2 Cl2 O10",
"formula_reduced": "KMoPClO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.4153867741666666,
"spacegroup": 129
},
{
"id": "jvasp-46707",
"created_at": "2022-09-04T14:38:33.732168Z",
"updated_at": "2022-09-04T14:38:33.732183Z",
"structure_string": "Li2 V2 P2 H2 O10\n1.0\n5.121339 0.030907 -0.008990\n-0.756235 5.318127 0.029658\n-2.350736 -2.432898 6.464164\nLi V P H O\n2 2 2 2 10\ndirect\n0.748515 0.392289 0.825470 Li\n0.251483 0.607711 0.174530 Li\n-0.000001 -0.000000 0.500000 V\n0.000000 0.000000 0.000000 V\n0.677248 0.364351 0.230121 P\n0.322750 0.635649 0.769879 P\n0.368179 0.065320 0.345996 H\n0.631820 0.934681 0.654004 H\n0.688142 0.660644 0.336999 O\n0.629258 0.753071 0.934377 O\n0.107928 0.654253 0.880497 O\n0.892070 0.345747 0.119502 O\n0.835030 0.039024 0.721329 O\n0.311856 0.339356 0.663000 O\n0.732533 0.212628 0.384691 O\n0.267466 0.787372 0.615309 O\n0.370740 0.246929 0.065623 O\n0.164968 0.960977 0.278671 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Li",
"V",
"P",
"H",
"O"
],
"chemical_system": "H-Li-O-P-V",
"density": 3.1971194512696326,
"density_atomic": 0.10201360185747396,
"volume": 176.44705874760015,
"volume_molar": 5.903272358144653,
"formula_full": "Li2 V2 P2 H2 O10",
"formula_reduced": "LiVPHO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.731286355555556,
"spacegroup": 2
},
{
"id": "jvasp-63195",
"created_at": "2022-09-04T14:35:46.000551Z",
"updated_at": "2022-09-04T14:35:46.000591Z",
"structure_string": "Ca4 Si4 B4 H4 O20\n1.0\n0.000000 4.842603 0.002245\n7.642604 0.000000 0.000000\n0.000000 -0.033624 -9.706613\nCa Si B H O\n4 4 4 4 20\ndirect\n0.991983 0.393728 0.836445 Ca\n0.008018 0.893728 0.663556 Ca\n0.008018 0.606271 0.163556 Ca\n0.991982 0.106272 0.336445 Ca\n0.529259 0.732419 0.915938 Si\n0.470742 0.232420 0.584062 Si\n0.470741 0.267580 0.084062 Si\n0.529258 0.767580 0.415938 Si\n0.428421 0.911368 0.159027 B\n0.571579 0.411368 0.340973 B\n0.571579 0.088632 0.840973 B\n0.428421 0.588631 0.659027 B\n0.810016 0.535134 0.577367 H\n0.189984 0.035134 0.922633 H\n0.810016 0.964865 0.077367 H\n0.189984 0.464865 0.422633 H\n0.678306 0.335265 0.211203 O\n0.261005 0.413739 0.336686 O\n0.738995 0.913739 0.163314 O\n0.687372 0.588990 0.354290 O\n0.312628 0.088990 0.145711 O\n0.312629 0.411009 0.645711 O\n0.687372 0.911009 0.854289 O\n0.321693 0.835265 0.288798 O\n0.678307 0.164734 0.711203 O\n0.241715 0.095461 0.535979 O\n0.325916 0.697576 0.542363 O\n0.674084 0.197576 0.957637 O\n0.674084 0.302423 0.457637 O\n0.325916 0.802423 0.042364 O\n0.758286 0.904538 0.464022 O\n0.241714 0.404538 0.035979 O\n0.261005 0.086261 0.836686 O\n0.758286 0.595461 0.964022 O\n0.321694 0.664734 0.788797 O\n0.738995 0.586260 0.663314 O\n",
"nsites": 36,
"nelements": 5,
"elements": [
"Ca",
"Si",
"B",
"H",
"O"
],
"chemical_system": "B-Ca-H-O-Si",
"density": 2.957917246966626,
"density_atomic": 0.10021096849344167,
"volume": 359.24211232781397,
"volume_molar": 6.009462687105075,
"formula_full": "Ca4 Si4 B4 H4 O20",
"formula_reduced": "CaSiBHO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.564916567037037,
"spacegroup": 14
},
{
"id": "jvasp-113186",
"created_at": "2022-09-04T14:38:47.703663Z",
"updated_at": "2022-09-04T14:38:47.703696Z",
"structure_string": "Rb2 Mo2 P2 Cl2 O10\n1.0\n6.500234 -0.000000 0.000000\n0.000000 6.500234 0.000000\n-0.000000 -0.000000 7.423700\nRb Mo P Cl O\n2 2 2 2 10\ndirect\n0.000000 0.000000 0.500000 Rb\n0.500000 0.500000 0.500000 Rb\n0.500000 0.000000 0.093050 Mo\n-0.000000 0.500000 0.906950 Mo\n0.500000 0.500000 -0.000000 P\n0.000000 0.000000 0.000000 P\n-0.000000 0.500000 0.556601 Cl\n0.500000 0.000000 0.443399 Cl\n0.500000 0.688390 0.127182 O\n-0.000000 0.188390 0.872818 O\n0.688390 0.500000 0.872818 O\n0.311609 0.500000 0.872818 O\n0.188390 0.000000 0.127182 O\n0.500000 0.000000 0.868085 O\n0.500000 0.311609 0.127182 O\n-0.000000 0.500000 0.131915 O\n0.811609 0.000000 0.127182 O\n-0.000000 0.811609 0.872818 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Rb",
"Mo",
"P",
"Cl",
"O"
],
"chemical_system": "Cl-Mo-O-P-Rb",
"density": 3.470974802542837,
"density_atomic": 0.05738443499315885,
"volume": 313.67390830189214,
"volume_molar": 10.494380158518483,
"formula_full": "Rb2 Mo2 P2 Cl2 O10",
"formula_reduced": "RbMoPClO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.412450329722222,
"spacegroup": 129
},
{
"id": "jvasp-8412",
"created_at": "2022-09-04T14:37:06.263666Z",
"updated_at": "2022-09-04T14:37:06.263691Z",
"structure_string": "Ba1 Y1 Cu1 Bi1 O5\n1.0\n3.924947 0.000000 0.000000\n0.000000 3.924947 0.000000\n-0.000000 0.000000 9.214530\nBa Y Cu Bi O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.052925 Ba\n0.000000 0.000000 0.444468 Y\n0.500000 0.500000 0.266194 Cu\n0.500000 0.500000 0.711550 Bi\n0.000000 0.500000 0.587593 O\n0.500000 0.000000 0.587593 O\n0.000000 0.500000 0.282636 O\n0.500000 0.000000 0.282636 O\n0.500000 0.500000 0.972318 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Y",
"Cu",
"Bi",
"O"
],
"chemical_system": "Ba-Bi-Cu-O-Y",
"density": 6.770239148935927,
"density_atomic": 0.063401820426233,
"volume": 141.95176005192712,
"volume_molar": 9.498372001805002,
"formula_full": "Ba1 Y1 Cu1 Bi1 O5",
"formula_reduced": "BaYCuBiO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.752133741111111,
"spacegroup": 99
},
{
"id": "jvasp-8416",
"created_at": "2022-09-04T14:36:49.375409Z",
"updated_at": "2022-09-04T14:36:49.375436Z",
"structure_string": "Ba1 Y1 V1 Cu1 O5\n1.0\n3.915847 0.000000 0.000000\n0.000000 3.915879 0.000000\n0.000000 0.000000 7.682006\nBa Y V Cu O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.005315 Ba\n0.000000 0.000000 0.546253 Y\n0.500000 0.500000 0.305114 V\n0.500000 0.500000 0.730086 Cu\n0.500000 0.000000 0.353649 O\n0.000000 0.500000 0.353655 O\n0.500000 0.000000 0.723559 O\n0.000000 0.500000 0.723557 O\n0.500000 0.500000 0.070897 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Y",
"V",
"Cu",
"O"
],
"chemical_system": "Ba-Cu-O-V-Y",
"density": 5.930753848069729,
"density_atomic": 0.07640343581860168,
"volume": 117.79574967502707,
"volume_molar": 7.882028727474857,
"formula_full": "Ba1 Y1 V1 Cu1 O5",
"formula_reduced": "BaYVCuO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.160798174444444,
"spacegroup": 99
},
{
"id": "jvasp-110944",
"created_at": "2022-09-04T14:38:48.275021Z",
"updated_at": "2022-09-04T14:38:48.275048Z",
"structure_string": "Ba1 Sm1 Fe1 Cu1 O5\n1.0\n3.924349 0.000000 0.000000\n0.000000 3.924349 0.000000\n-0.000000 -0.000000 7.683975\nBa Sm Fe Cu O\n1 1 1 1 5\ndirect\n0.500000 0.500000 0.727170 Ba\n0.500000 0.500000 0.203212 Sm\n0.000000 0.000000 0.448602 Fe\n0.000000 0.000000 0.993677 Cu\n0.500000 0.000000 0.398359 O\n-0.000000 0.500000 0.398359 O\n0.500000 0.000000 0.015112 O\n-0.000000 0.500000 0.015112 O\n0.000000 0.000000 0.688393 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Sm",
"Fe",
"Cu",
"O"
],
"chemical_system": "Ba-Cu-Fe-O-Sm",
"density": 6.834767525957598,
"density_atomic": 0.07605387036016185,
"volume": 118.33717281421004,
"volume_molar": 7.918256798084646,
"formula_full": "Ba1 Sm1 Fe1 Cu1 O5",
"formula_reduced": "BaSmFeCuO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.892336477222222,
"spacegroup": 99
},
{
"id": "jvasp-30732",
"created_at": "2022-09-04T14:38:07.750974Z",
"updated_at": "2022-09-04T14:38:07.751001Z",
"structure_string": "Ba1 Y1 Cu1 Sn1 O5\n1.0\n3.984690 0.000000 0.000000\n0.000000 3.984690 0.000000\n0.000000 0.000000 8.405146\nBa Y Cu Sn O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.032630 Ba\n0.000000 0.000000 0.442637 Y\n0.499999 0.499999 0.277921 Cu\n0.499999 0.499999 0.700004 Sn\n0.000000 0.499999 0.618246 O\n0.499999 0.000000 0.618246 O\n0.000000 0.499999 0.279622 O\n0.499999 0.000000 0.279622 O\n0.499999 0.499999 0.938989 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Y",
"Cu",
"Sn",
"O"
],
"chemical_system": "Ba-Cu-O-Sn-Y",
"density": 6.078084646442206,
"density_atomic": 0.06743854130932787,
"volume": 133.45484385136234,
"volume_molar": 8.929820608630273,
"formula_full": "Ba1 Y1 Cu1 Sn1 O5",
"formula_reduced": "BaYCuSnO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.675342341111111,
"spacegroup": 99
},
{
"id": "jvasp-61086",
"created_at": "2022-09-04T14:36:16.728375Z",
"updated_at": "2022-09-04T14:36:16.728404Z",
"structure_string": "Ca4 Si4 B4 H4 O20\n1.0\n0.000000 4.842615 0.003450\n7.642579 0.000000 0.000000\n0.000000 -0.031377 -9.706487\nCa Si B H O\n4 4 4 4 20\ndirect\n0.991979 0.393731 0.836442 Ca\n0.008019 0.893731 0.663558 Ca\n0.008019 0.606269 0.163558 Ca\n0.991980 0.106269 0.336442 Ca\n0.529260 0.732421 0.915934 Si\n0.470738 0.232421 0.584066 Si\n0.470738 0.267579 0.084066 Si\n0.529261 0.767579 0.415934 Si\n0.428421 0.911365 0.159023 B\n0.571578 0.411365 0.340977 B\n0.571577 0.088635 0.840977 B\n0.428421 0.588635 0.659023 B\n0.810012 0.535144 0.577359 H\n0.189986 0.035144 0.922642 H\n0.810013 0.964856 0.077359 H\n0.189986 0.464856 0.422641 H\n0.678301 0.335258 0.211208 O\n0.261009 0.413738 0.336691 O\n0.738989 0.913738 0.163309 O\n0.687375 0.588991 0.354287 O\n0.312623 0.088991 0.145713 O\n0.312623 0.411009 0.645713 O\n0.687375 0.911009 0.854287 O\n0.321698 0.835258 0.288792 O\n0.678301 0.164742 0.711208 O\n0.241713 0.095458 0.535989 O\n0.325913 0.697575 0.542354 O\n0.674085 0.197575 0.957646 O\n0.674086 0.302425 0.457646 O\n0.325913 0.802425 0.042354 O\n0.758285 0.904542 0.464011 O\n0.241713 0.404542 0.035989 O\n0.261009 0.086262 0.836691 O\n0.758285 0.595458 0.964012 O\n0.321697 0.664742 0.788792 O\n0.738989 0.586262 0.663309 O\n",
"nsites": 36,
"nelements": 5,
"elements": [
"Ca",
"Si",
"B",
"H",
"O"
],
"chemical_system": "B-Ca-H-O-Si",
"density": 2.9579600516932367,
"density_atomic": 0.10021241867028965,
"volume": 359.23691372467647,
"volume_molar": 6.009375723994382,
"formula_full": "Ca4 Si4 B4 H4 O20",
"formula_reduced": "CaSiBHO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.564916567037037,
"spacegroup": 14
},
{
"id": "jvasp-8419",
"created_at": "2022-09-04T14:37:10.071028Z",
"updated_at": "2022-09-04T14:37:10.071050Z",
"structure_string": "Ba1 Al1 Cu1 Ni1 O5\n1.0\n3.713012 0.000000 0.000000\n0.000000 3.713012 0.000000\n0.000000 -0.000000 7.458926\nBa Al Cu Ni O\n1 1 1 1 5\ndirect\n0.000000 0.000000 0.969816 Ba\n0.000000 0.000000 0.462622 Al\n0.500000 0.500000 0.249079 Cu\n0.500000 0.500000 0.687721 Ni\n0.000000 0.500000 0.628536 O\n0.500000 0.000000 0.628536 O\n0.000000 0.500000 0.304103 O\n0.500000 0.000000 0.304103 O\n0.500000 0.500000 0.953410 O\n",
"nsites": 9,
"nelements": 5,
"elements": [
"Ba",
"Al",
"Cu",
"Ni",
"O"
],
"chemical_system": "Al-Ba-Cu-Ni-O",
"density": 5.918986102462162,
"density_atomic": 0.0875212486975701,
"volume": 102.8321708605818,
"volume_molar": 6.880775639764377,
"formula_full": "Ba1 Al1 Cu1 Ni1 O5",
"formula_reduced": "BaAlCuNiO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.6654010133333337,
"spacegroup": 99
},
{
"id": "jvasp-85779",
"created_at": "2022-09-04T14:36:20.803831Z",
"updated_at": "2022-09-04T14:36:20.803859Z",
"structure_string": "Tl2 Cu2 H2 S2 O10\n1.0\n8.842240 0.000000 -0.886728\n0.000000 5.877755 0.000000\n-0.033881 0.000000 4.516345\nTl Cu H S O\n2 2 2 2 10\ndirect\n0.604870 0.250000 0.886481 Tl\n0.395130 0.749999 0.113520 Tl\n0.000000 0.500000 0.000000 Cu\n0.000000 0.000000 0.000000 Cu\n0.892893 0.250000 0.589183 H\n0.107107 0.749999 0.410817 H\n0.227325 0.250000 0.510706 S\n0.772675 0.749999 0.489295 S\n0.641148 0.749999 0.660799 O\n0.358852 0.250000 0.339202 O\n0.220529 0.041262 0.689753 O\n0.779471 0.541261 0.310247 O\n0.891026 0.250000 0.807004 O\n0.220529 0.458738 0.689753 O\n0.108975 0.749999 0.192997 O\n0.078953 0.250000 0.291743 O\n0.779471 0.958737 0.310247 O\n0.921047 0.749999 0.708258 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Tl",
"Cu",
"H",
"S",
"O"
],
"chemical_system": "Cu-H-O-S-Tl",
"density": 5.394723144883549,
"density_atomic": 0.07674294556558987,
"volume": 234.54924576247785,
"volume_molar": 7.847158739630418,
"formula_full": "Tl2 Cu2 H2 S2 O10",
"formula_reduced": "TlCuHSO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 1.904603394444444,
"spacegroup": 11
},
{
"id": "jvasp-85369",
"created_at": "2022-09-04T14:37:40.311112Z",
"updated_at": "2022-09-04T14:37:40.311137Z",
"structure_string": "Zn2 Co2 P2 H2 O10\n1.0\n5.164717 0.013338 -0.915075\n-0.329739 5.471305 -0.460465\n0.014869 0.013198 7.460947\nZn Co P H O\n2 2 2 2 10\ndirect\n0.628059 0.207111 0.632416 Zn\n0.371942 0.792890 0.367586 Zn\n0.000000 0.000000 0.000000 Co\n-0.000000 0.500000 0.000000 Co\n0.554294 0.297416 0.218901 P\n0.445706 0.702586 0.781101 P\n0.113293 0.261601 0.724650 H\n0.886707 0.738401 0.275352 H\n0.731992 0.250823 0.077176 O\n0.596803 0.103990 0.363249 O\n0.037615 0.774365 0.215917 O\n0.735626 0.725810 0.871869 O\n0.378760 0.446100 0.677146 O\n0.962386 0.225637 0.784085 O\n0.621240 0.553901 0.322856 O\n0.403197 0.896012 0.636753 O\n0.264375 0.274192 0.128133 O\n0.268009 0.749179 0.922826 O\n",
"nsites": 18,
"nelements": 5,
"elements": [
"Zn",
"Co",
"P",
"H",
"O"
],
"chemical_system": "Co-H-O-P-Zn",
"density": 3.720114397919261,
"density_atomic": 0.08531935836289166,
"volume": 210.97205072077548,
"volume_molar": 7.058352143702052,
"formula_full": "Zn2 Co2 P2 H2 O10",
"formula_reduced": "ZnCoPHO5",
"formula_anonymous": "ABCDE5",
"energy_above_hull": 2.357190477777777,
"spacegroup": 2
}
]
}