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=nelements&page=4551",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4549",
"results": [
{
"id": "jvasp-26381",
"created_at": "2022-09-04T14:37:51.307419Z",
"updated_at": "2022-09-04T14:37:51.307451Z",
"structure_string": "Sm2 Zn2 P2 O2\n1.0\n3.894797 0.004055 9.811714\n1.879494 3.411298 9.811714\n0.006856 0.004055 10.556473\nSm Zn P O\n2 2 2 2\ndirect\n0.380632 0.380634 0.380631 Sm\n0.619367 0.619370 0.619366 Sm\n0.196542 0.196543 0.196542 Zn\n0.803457 0.803460 0.803455 Zn\n0.112938 0.112939 0.112938 P\n0.887061 0.887065 0.887059 P\n0.694756 0.694759 0.694754 O\n0.305244 0.305245 0.305243 O\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sm",
"Zn",
"P",
"O"
],
"chemical_system": "O-P-Sm-Zn",
"density": 6.2387031644833755,
"density_atomic": 0.0571972893019885,
"volume": 139.86676812185704,
"volume_molar": 10.528717065951298,
"formula_full": "Sm2 Zn2 P2 O2",
"formula_reduced": "SmZnPO",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.83873206875,
"spacegroup": 166
},
{
"id": "jvasp-49214",
"created_at": "2022-09-04T14:38:03.221733Z",
"updated_at": "2022-09-04T14:38:03.221753Z",
"structure_string": "Zn4 B6 Se1 O12\n1.0\n6.310696 0.000000 -2.231168\n-3.155348 5.465223 -2.231168\n-0.000000 -0.000000 6.693504\nZn B Se O\n4 6 1 12\ndirect\n-0.000000 0.645659 -0.000000 Zn\n0.645660 -0.000000 -0.000000 Zn\n0.354340 0.354340 0.354340 Zn\n0.000000 0.000000 0.645659 Zn\n0.500000 0.250000 0.749999 B\n0.750000 0.500000 0.249999 B\n0.250000 0.500000 0.749999 B\n0.750000 0.250000 0.499999 B\n0.250000 0.750000 0.499999 B\n0.500000 0.750000 0.249999 B\n0.000000 0.000000 0.000000 Se\n-0.000000 0.714742 0.427578 O\n0.714743 -0.000000 0.427578 O\n0.427579 0.000000 0.714742 O\n-0.000000 0.427578 0.714742 O\n0.287163 0.572421 0.572421 O\n0.572422 0.287163 0.572421 O\n0.285258 0.285257 0.712836 O\n0.714743 0.427578 -0.000000 O\n0.427578 0.714742 -0.000001 O\n0.572422 0.572421 0.287162 O\n0.712837 0.285257 0.285257 O\n0.285257 0.712837 0.285257 O\n",
"nsites": 23,
"nelements": 4,
"elements": [
"Zn",
"B",
"Se",
"O"
],
"chemical_system": "B-O-Se-Zn",
"density": 4.297495966213705,
"density_atomic": 0.09962977777722087,
"volume": 230.85467531032342,
"volume_molar": 6.044518912273324,
"formula_full": "Zn4 B6 Se1 O12",
"formula_reduced": "Zn4B6SeO12",
"formula_anonymous": "AB4C6D12",
"energy_above_hull": 2.7198696724637683,
"spacegroup": 217
},
{
"id": "jvasp-21477",
"created_at": "2022-09-04T14:37:36.952330Z",
"updated_at": "2022-09-04T14:37:36.952340Z",
"structure_string": "K4 Be4 P4 O16\n1.0\n4.970129 0.000000 0.000000\n0.000000 8.302066 0.000000\n0.000000 0.000000 8.558773\nK Be P O\n4 4 4 16\ndirect\n0.253036 0.498209 0.286005 K\n0.753036 0.501792 0.713994 K\n0.753036 0.001791 0.786005 K\n0.253036 0.998209 0.213994 K\n0.740744 0.814016 0.412250 Be\n0.240744 0.185985 0.587749 Be\n0.240744 0.685985 0.912250 Be\n0.740744 0.314015 0.087750 Be\n0.739475 0.192740 0.419129 P\n0.239475 0.807261 0.580871 P\n0.239475 0.307260 0.919129 P\n0.739475 0.692740 0.080871 P\n0.241846 0.991212 0.587785 O\n0.741846 0.008789 0.412214 O\n0.043035 0.247507 0.048074 O\n0.543035 0.752494 0.951926 O\n0.543035 0.252494 0.548074 O\n0.043035 0.747507 0.451926 O\n0.025492 0.756555 0.043295 O\n0.141469 0.241799 0.760616 O\n0.525493 0.743445 0.543294 O\n0.025492 0.256555 0.456705 O\n0.641469 0.258202 0.260617 O\n0.141469 0.741799 0.739383 O\n0.241846 0.491211 0.912214 O\n0.641469 0.758202 0.239383 O\n0.525493 0.243445 0.956705 O\n0.741846 0.508789 0.087785 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"K",
"Be",
"P",
"O"
],
"chemical_system": "Be-K-O-P",
"density": 2.691090274851956,
"density_atomic": 0.07928530126462613,
"volume": 353.15499283462344,
"volume_molar": 7.595532417667477,
"formula_full": "K4 Be4 P4 O16",
"formula_reduced": "KBePO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.8252605142857143,
"spacegroup": 33
},
{
"id": "jvasp-12493",
"created_at": "2022-09-04T14:38:03.233246Z",
"updated_at": "2022-09-04T14:38:03.233261Z",
"structure_string": "Pb4 Cl2 O2 F2\n1.0\n5.261376 -0.000000 -2.399962\n0.000000 5.796715 -0.000000\n-0.015164 0.000000 6.933930\nPb Cl O F\n4 2 2 2\ndirect\n0.895888 0.221195 0.291774 Pb\n0.104114 0.778804 0.708227 Pb\n0.604114 0.221195 0.708227 Pb\n0.395888 0.778804 0.291773 Pb\n0.750001 0.779527 0.000000 Cl\n0.250000 0.220473 0.000000 Cl\n0.750001 0.000000 0.500001 O\n0.250001 0.000000 0.500000 O\n0.250001 0.500000 0.500000 F\n0.750001 0.500000 0.500001 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Pb",
"Cl",
"O",
"F"
],
"chemical_system": "Cl-F-O-Pb",
"density": 7.621841672431311,
"density_atomic": 0.047333945942483656,
"volume": 211.26487134943667,
"volume_molar": 12.722667929095985,
"formula_full": "Pb4 Cl2 O2 F2",
"formula_reduced": "Pb2ClOF",
"formula_anonymous": "ABCD2",
"energy_above_hull": 0.2689298979999999,
"spacegroup": 67
},
{
"id": "jvasp-39100",
"created_at": "2022-09-04T14:37:38.532462Z",
"updated_at": "2022-09-04T14:37:38.532472Z",
"structure_string": "Si2 Ge2 N4 O2\n1.0\n0.000000 5.398395 -0.002625\n5.022557 0.000000 0.000000\n0.000000 -2.443965 -4.827215\nSi Ge N O\n2 2 4 2\ndirect\n0.165866 0.314915 0.519812 Si\n0.834136 0.814916 0.480188 Si\n0.522047 0.316445 0.176114 Ge\n0.477955 0.816445 0.823886 Ge\n0.589736 0.674667 0.172460 N\n0.151212 0.653861 0.576277 N\n0.848790 0.153861 0.423723 N\n0.410266 0.174667 0.827540 N\n0.255340 0.244111 0.274354 O\n0.744662 0.744111 0.725646 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Si",
"Ge",
"N",
"O"
],
"chemical_system": "Ge-N-O-Si",
"density": 3.671719376267458,
"density_atomic": 0.07638479560262673,
"volume": 130.91610602746863,
"volume_molar": 7.883952182485006,
"formula_full": "Si2 Ge2 N4 O2",
"formula_reduced": "SiGeN2O",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.31821491,
"spacegroup": 4
},
{
"id": "jvasp-45246",
"created_at": "2022-09-04T14:38:03.679682Z",
"updated_at": "2022-09-04T14:38:03.679709Z",
"structure_string": "Na6 Sr6 Ga2 P8\n1.0\n4.694754 -8.131552 -0.000000\n4.694754 8.131552 -0.000000\n-0.000000 -0.000000 7.379094\nNa Sr Ga P\n6 6 2 8\ndirect\n0.134021 0.865978 0.830949 Na\n0.865977 0.731957 0.330949 Na\n0.268042 0.134022 0.330949 Na\n0.731957 0.865977 0.830949 Na\n0.134022 0.268042 0.830949 Na\n0.865978 0.134021 0.330949 Na\n0.477423 0.522576 0.500114 Sr\n0.477423 0.954846 0.500114 Sr\n0.522576 0.477423 0.000114 Sr\n0.954846 0.477423 0.000114 Sr\n0.522577 0.045154 0.000114 Sr\n0.045154 0.522577 0.500114 Sr\n0.666667 0.333333 0.625154 Ga\n0.333333 0.666667 0.125154 Ga\n0.810304 0.620608 0.720080 P\n0.333333 0.666667 0.783414 P\n0.810304 0.189695 0.720080 P\n0.189695 0.379391 0.220080 P\n0.620608 0.810304 0.220080 P\n0.379391 0.189695 0.720080 P\n0.666667 0.333333 0.283414 P\n0.189695 0.810304 0.220080 P\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Na",
"Sr",
"Ga",
"P"
],
"chemical_system": "Ga-Na-P-Sr",
"density": 3.0973407149838255,
"density_atomic": 0.039048410317590584,
"volume": 563.4032172134139,
"volume_molar": 15.42224308498197,
"formula_full": "Na6 Sr6 Ga2 P8",
"formula_reduced": "Na3Sr3GaP4",
"formula_anonymous": "AB3C3D4",
"energy_above_hull": 0.7610072959090912,
"spacegroup": 186
},
{
"id": "jvasp-28498",
"created_at": "2022-09-04T14:37:37.829968Z",
"updated_at": "2022-09-04T14:37:37.829976Z",
"structure_string": "Te4 Mo1 W2 Se2\n1.0\n3.484481 0.000091 -0.139348\n-1.745367 3.018918 -0.007264\n-0.922864 -0.487245 20.967066\nTe Mo W Se\n4 1 2 2\ndirect\n0.397799 0.698439 0.441564 Te\n0.383386 0.192839 0.919057 Te\n0.502305 0.252516 0.095368 Te\n0.278428 0.638588 0.264438 Te\n0.109481 0.555990 0.007180 Mo\n0.552364 0.775438 0.680767 W\n0.671459 0.335192 0.353020 W\n0.833161 0.415728 0.602800 Se\n0.938215 0.468466 0.758650 Se\n",
"nsites": 9,
"nelements": 4,
"elements": [
"Te",
"Mo",
"W",
"Se"
],
"chemical_system": "Mo-Se-Te-W",
"density": 8.542050353199496,
"density_atomic": 0.04090083101699465,
"volume": 220.04442883472032,
"volume_molar": 14.723761376627651,
"formula_full": "Te4 Mo1 W2 Se2",
"formula_reduced": "Te4Mo(WSe)2",
"formula_anonymous": "AB2C2D4",
"energy_above_hull": 3.692990411111111,
"spacegroup": 160
},
{
"id": "jvasp-90630",
"created_at": "2022-09-04T14:37:51.290166Z",
"updated_at": "2022-09-04T14:37:51.290189Z",
"structure_string": "Ca2 Ni2 Ge2 H2\n1.0\n3.984147 -0.000000 -0.000000\n0.000000 3.984147 0.000000\n-0.000000 -0.000000 7.748305\nCa Ni Ge H\n2 2 2 2\ndirect\n0.750001 0.750001 0.848997 Ca\n0.250000 0.250000 0.151003 Ca\n0.750001 0.250000 0.500000 Ni\n0.250000 0.750001 0.500000 Ni\n0.750001 0.750001 0.338279 Ge\n0.250000 0.250000 0.661721 Ge\n0.750001 0.250000 0.000000 H\n0.250000 0.750001 0.000000 H\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Ca",
"Ni",
"Ge",
"H"
],
"chemical_system": "Ca-Ge-H-Ni",
"density": 4.65572860305626,
"density_atomic": 0.06504479833330092,
"volume": 122.99215625216642,
"volume_molar": 9.258450966580755,
"formula_full": "Ca2 Ni2 Ge2 H2",
"formula_reduced": "CaNiGeH",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.8426746924999999,
"spacegroup": 129
},
{
"id": "jvasp-9299",
"created_at": "2022-09-04T14:37:51.675758Z",
"updated_at": "2022-09-04T14:37:51.675774Z",
"structure_string": "Ba1 Ca1 Sb4 O8\n1.0\n3.114223 -5.393991 -0.000000\n3.114223 5.393991 0.000000\n-0.000000 -0.000000 7.328267\nBa Ca Sb O\n1 1 4 8\ndirect\n0.000000 0.000000 0.000000 Ba\n0.000000 0.000000 0.500000 Ca\n0.333333 0.666667 0.725711 Sb\n0.666667 0.333333 0.725711 Sb\n0.333333 0.666667 0.274289 Sb\n0.666667 0.333333 0.274289 Sb\n0.297140 0.297140 0.717991 O\n0.702859 -0.000000 0.717991 O\n-0.000000 0.702859 0.717991 O\n0.702859 0.702859 0.282010 O\n-0.000000 0.297141 0.282010 O\n0.297141 -0.000000 0.282010 O\n0.333333 0.666667 0.000000 O\n0.666667 0.333333 0.000000 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Ca",
"Sb",
"O"
],
"chemical_system": "Ba-Ca-O-Sb",
"density": 5.344713021861515,
"density_atomic": 0.05686392463533426,
"volume": 246.20178944350673,
"volume_molar": 10.590441652804854,
"formula_full": "Ba1 Ca1 Sb4 O8",
"formula_reduced": "BaCa(SbO2)4",
"formula_anonymous": "ABC4D8",
"energy_above_hull": 2.084276342142857,
"spacegroup": 162
},
{
"id": "jvasp-29154",
"created_at": "2022-09-04T14:37:51.241125Z",
"updated_at": "2022-09-04T14:37:51.241150Z",
"structure_string": "Mo2 W2 Se6 S2\n1.0\n3.291125 0.000021 -0.000193\n-1.645545 2.850077 -0.001523\n-0.002020 -0.019539 34.367267\nMo W Se S\n2 2 6 2\ndirect\n0.333422 0.666960 0.094713 Mo\n0.333344 0.666749 0.467109 Mo\n0.666656 0.333259 0.280922 W\n0.666594 0.333078 0.660182 W\n0.333711 0.667222 0.709475 Se\n0.666349 0.332883 0.045699 Se\n0.666195 0.332526 0.418055 Se\n0.667129 0.334064 0.143775 Se\n0.667208 0.334164 0.516173 Se\n0.332761 0.665712 0.610806 Se\n0.333724 0.667327 0.325808 S\n0.332926 0.666061 0.236033 S\n",
"nsites": 12,
"nelements": 4,
"elements": [
"Mo",
"W",
"Se",
"S"
],
"chemical_system": "Mo-S-Se-W",
"density": 5.653096697561822,
"density_atomic": 0.03722492401954339,
"volume": 322.36466066928443,
"volume_molar": 16.177711355000557,
"formula_full": "Mo2 W2 Se6 S2",
"formula_reduced": "MoWSe3S",
"formula_anonymous": "ABCD3",
"energy_above_hull": 3.591872666666666,
"spacegroup": 156
},
{
"id": "jvasp-9765",
"created_at": "2022-09-04T14:38:03.534232Z",
"updated_at": "2022-09-04T14:38:03.534242Z",
"structure_string": "Li3 Cd3 B3 O9\n1.0\n4.186701 -7.251580 0.000000\n4.186701 7.251580 -0.000000\n0.000000 -0.000000 3.267125\nLi Cd B O\n3 3 3 9\ndirect\n0.291047 0.007309 0.500001 Li\n0.716262 0.708953 0.500001 Li\n0.992691 0.283737 0.500001 Li\n0.631160 0.995642 0.000000 Cd\n0.004358 0.635519 0.000000 Cd\n0.364481 0.368839 0.000000 Cd\n0.666667 0.333333 0.500001 B\n0.333333 0.666667 0.500001 B\n0.000000 0.000000 0.000000 B\n0.857161 0.414828 0.500001 O\n0.188359 0.061773 0.000000 O\n0.938227 0.126587 0.000000 O\n0.873412 0.811641 0.000000 O\n0.246842 0.475377 0.500001 O\n0.228535 0.753158 0.500001 O\n0.524623 0.771465 0.500001 O\n0.585171 0.442333 0.500001 O\n0.557667 0.142838 0.500001 O\n",
"nsites": 18,
"nelements": 4,
"elements": [
"Li",
"Cd",
"B",
"O"
],
"chemical_system": "B-Cd-Li-O",
"density": 4.473867793604467,
"density_atomic": 0.09073444140708774,
"volume": 198.38111879965712,
"volume_molar": 6.637105675210097,
"formula_full": "Li3 Cd3 B3 O9",
"formula_reduced": "LiCdBO3",
"formula_anonymous": "ABCD3",
"energy_above_hull": 1.5879288055555558,
"spacegroup": 174
},
{
"id": "jvasp-19396",
"created_at": "2022-09-04T14:37:36.119649Z",
"updated_at": "2022-09-04T14:37:36.119676Z",
"structure_string": "Ca4 Sb2 Mo2 O12\n1.0\n0.000000 5.559729 -0.035266\n8.036466 0.000000 0.000000\n0.000000 0.026688 -5.819631\nCa Sb Mo O\n4 2 2 12\ndirect\n0.482009 0.250000 0.565390 Ca\n0.517991 0.750000 0.434611 Ca\n0.011405 0.250000 0.057845 Ca\n0.988596 0.750000 0.942155 Ca\n0.000000 0.500000 0.500000 Sb\n0.000000 0.000000 0.500000 Sb\n0.500000 0.500000 0.000000 Mo\n0.500000 0.000000 0.000000 Mo\n0.329967 0.438922 0.288769 O\n0.599893 0.250000 0.962587 O\n0.670033 0.938922 0.711232 O\n0.116466 0.750000 0.545839 O\n0.206474 0.059747 0.820194 O\n0.793527 0.940254 0.179807 O\n0.206474 0.440254 0.820194 O\n0.329967 0.061078 0.288769 O\n0.883535 0.250000 0.454161 O\n0.670033 0.561079 0.711232 O\n0.793527 0.559747 0.179807 O\n0.400108 0.750000 0.037414 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ca",
"Sb",
"Mo",
"O"
],
"chemical_system": "Ca-Mo-O-Sb",
"density": 5.0304986779113685,
"density_atomic": 0.07691808185463704,
"volume": 260.0168844277321,
"volume_molar": 7.829291390002274,
"formula_full": "Ca4 Sb2 Mo2 O12",
"formula_reduced": "Ca2SbMoO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.299174384,
"spacegroup": 11
}
]
}