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=4434",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=4432",
"results": [
{
"id": "jvasp-101517",
"created_at": "2022-09-04T14:36:41.295519Z",
"updated_at": "2022-09-04T14:36:41.295538Z",
"structure_string": "Rb2 Y1 Ag1 F6\n1.0\n5.589605 -0.000000 3.227160\n1.863202 5.269930 3.227160\n-0.000000 -0.000000 6.454320\nRb Y Ag F\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Ag\n0.736578 0.263422 0.263422 F\n0.263422 0.263422 0.736578 F\n0.263422 0.736578 0.736578 F\n0.263422 0.736578 0.263422 F\n0.736578 0.263422 0.736577 F\n0.736578 0.736578 0.263422 F\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Y",
"Ag",
"F"
],
"chemical_system": "Ag-F-Rb-Y",
"density": 4.207163086217585,
"density_atomic": 0.052597310929001495,
"volume": 190.12378814381793,
"volume_molar": 11.449522140264909,
"formula_full": "Rb2 Y1 Ag1 F6",
"formula_reduced": "Rb2YAgF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-103753",
"created_at": "2022-09-04T14:36:55.433610Z",
"updated_at": "2022-09-04T14:36:55.433619Z",
"structure_string": "Li1 Co2 Cu1 O6\n1.0\n6.138135 -0.017645 1.270537\n5.506399 2.712303 1.270537\n-0.245451 -0.056800 5.853658\nLi Co Cu O\n1 2 1 6\ndirect\n0.000000 0.000000 0.000000 Li\n0.682248 0.682244 0.181968 Co\n0.317755 0.317753 0.818033 Co\n0.000000 -0.000000 0.500000 Cu\n0.192752 0.192751 0.372782 O\n0.474458 0.474454 0.727486 O\n0.832278 0.832273 0.034403 O\n0.525546 0.525543 0.272515 O\n0.807252 0.807247 0.627219 O\n0.167726 0.167725 0.965598 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Li",
"Co",
"Cu",
"O"
],
"chemical_system": "Co-Cu-Li-O",
"density": 4.773281216892864,
"density_atomic": 0.10109158647568091,
"volume": 98.92020046995354,
"volume_molar": 5.957113712374785,
"formula_full": "Li1 Co2 Cu1 O6",
"formula_reduced": "LiCo2CuO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.4395373250000003,
"spacegroup": 12
},
{
"id": "jvasp-15672",
"created_at": "2022-09-04T14:36:55.464605Z",
"updated_at": "2022-09-04T14:36:55.464632Z",
"structure_string": "Nd1 Ni2 B2 C1\n1.0\n3.516167 -0.000000 -1.205108\n-0.413031 3.491824 -1.205108\n-0.035042 -0.039432 5.629905\nNd Ni B C\n1 2 2 1\ndirect\n0.000000 0.000000 0.000000 Nd\n0.250001 0.749999 0.499999 Ni\n0.750001 0.250000 0.499999 Ni\n0.350594 0.350593 0.701185 B\n0.649408 0.649406 0.298813 B\n0.500001 0.499999 -0.000000 C\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Nd",
"Ni",
"B",
"C"
],
"chemical_system": "B-C-Nd-Ni",
"density": 7.127507495771125,
"density_atomic": 0.08722340045482813,
"volume": 68.78887968954298,
"volume_molar": 6.904271936885548,
"formula_full": "Nd1 Ni2 B2 C1",
"formula_reduced": "NdNi2B2C",
"formula_anonymous": "ABC2D2",
"energy_above_hull": 3.3733169111111105,
"spacegroup": 139
},
{
"id": "jvasp-104538",
"created_at": "2022-09-04T14:36:47.690446Z",
"updated_at": "2022-09-04T14:36:47.690473Z",
"structure_string": "Rb2 Li1 Tl1 Br6\n1.0\n6.677314 -0.000000 3.855149\n2.225771 6.295432 3.855149\n-0.000000 -0.000000 7.710298\nRb Li Tl Br\n2 1 1 6\ndirect\n0.749999 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Tl\n0.745836 0.254163 0.254164 Br\n0.254163 0.254163 0.745837 Br\n0.254163 0.745836 0.745837 Br\n0.254163 0.745836 0.254164 Br\n0.745836 0.254163 0.745837 Br\n0.745836 0.745836 0.254164 Br\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Rb",
"Li",
"Tl",
"Br"
],
"chemical_system": "Br-Li-Rb-Tl",
"density": 4.41467335834139,
"density_atomic": 0.030853291308496365,
"volume": 324.1145296303025,
"volume_molar": 19.518633197948724,
"formula_full": "Rb2 Li1 Tl1 Br6",
"formula_reduced": "Rb2LiTlBr6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-14293",
"created_at": "2022-09-04T14:36:55.866065Z",
"updated_at": "2022-09-04T14:36:55.866093Z",
"structure_string": "Na4 Y4 Si4 O16\n1.0\n5.162955 0.000000 0.000000\n0.000000 6.438606 0.000000\n0.000000 0.000000 11.214821\nNa Y Si O\n4 4 4 16\ndirect\n0.500000 0.751860 -0.000001 Na\n0.500001 0.251860 0.000001 Na\n-0.000000 0.251860 0.500001 Na\n0.000000 0.751860 0.499999 Na\n0.500989 0.501857 0.720073 Y\n0.499012 0.001856 0.279927 Y\n-0.000989 0.501857 0.220073 Y\n0.000989 0.001856 0.779927 Y\n0.062423 0.501857 0.901361 Si\n0.437578 0.501857 0.401361 Si\n0.937578 0.001856 0.098639 Si\n0.562423 0.001856 0.598639 Si\n0.796721 0.200750 0.170585 O\n0.203280 0.700750 0.829415 O\n0.203281 0.302963 0.829416 O\n0.796720 0.802964 0.170584 O\n0.296720 0.302963 0.329416 O\n0.703281 0.802964 0.670584 O\n0.329799 0.501857 0.538867 O\n0.251398 0.001857 0.111568 O\n0.170201 0.501857 0.038867 O\n0.829800 0.001857 0.961133 O\n0.248602 0.001857 0.611568 O\n0.751399 0.501857 0.388432 O\n0.296720 0.700750 0.329415 O\n0.748603 0.501857 0.888432 O\n0.670202 0.001857 0.461133 O\n0.703281 0.200750 0.670585 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Na",
"Y",
"Si",
"O"
],
"chemical_system": "Na-O-Si-Y",
"density": 3.63422166887313,
"density_atomic": 0.07510614915844153,
"volume": 372.8056931920727,
"volume_molar": 8.018172716185841,
"formula_full": "Na4 Y4 Si4 O16",
"formula_reduced": "NaYSiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 1.9888438642857145,
"spacegroup": 62
},
{
"id": "jvasp-104695",
"created_at": "2022-09-04T14:36:55.535697Z",
"updated_at": "2022-09-04T14:36:55.535728Z",
"structure_string": "Sm1 Mn1 Co3 Cu1\n1.0\n5.002144 0.000000 0.000000\n-2.501071 4.331984 0.000000\n0.000000 -0.000000 3.880781\nSm Mn Co Cu\n1 1 3 1\ndirect\n0.666666 0.333333 -0.000000 Sm\n0.333333 0.666666 -0.000000 Mn\n0.666034 0.833017 0.500000 Co\n0.166982 0.833017 0.500000 Co\n0.166983 0.333965 0.500000 Co\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 6,
"nelements": 4,
"elements": [
"Sm",
"Mn",
"Co",
"Cu"
],
"chemical_system": "Co-Cu-Mn-Sm",
"density": 8.799837074589542,
"density_atomic": 0.07134919560711557,
"volume": 84.09344981321173,
"volume_molar": 8.440376529485945,
"formula_full": "Sm1 Mn1 Co3 Cu1",
"formula_reduced": "SmMnCo3Cu",
"formula_anonymous": "ABCD3",
"energy_above_hull": 2.802111544396552,
"spacegroup": 187
},
{
"id": "jvasp-45321",
"created_at": "2022-09-04T14:36:47.666320Z",
"updated_at": "2022-09-04T14:36:47.666340Z",
"structure_string": "Sr4 Sm2 Nb2 O12\n1.0\n0.000000 5.877900 0.001086\n6.018927 0.000000 0.000000\n0.000000 -5.840227 -8.380156\nSr Sm Nb O\n4 2 2 12\ndirect\n0.739693 0.955072 0.250976 Sr\n0.260307 0.455072 0.249024 Sr\n0.260306 0.044929 0.749024 Sr\n0.739693 0.544929 0.750976 Sr\n-0.000000 0.500000 0.500000 Sm\n0.000000 0.000000 0.000000 Sm\n0.500000 0.500000 -0.000000 Nb\n0.500000 0.000000 0.500000 Nb\n0.269440 0.810118 0.546866 O\n0.730559 0.310118 0.953135 O\n0.825689 0.533089 0.231974 O\n0.174310 0.033089 0.268026 O\n0.174310 0.466911 0.768026 O\n0.632890 0.723014 0.446882 O\n0.367110 0.276987 0.553118 O\n0.632890 0.776987 0.946882 O\n0.269440 0.689882 0.046865 O\n0.367110 0.223013 0.053118 O\n0.825689 0.966911 0.731974 O\n0.730559 0.189882 0.453135 O\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Sr",
"Sm",
"Nb",
"O"
],
"chemical_system": "Nb-O-Sm-Sr",
"density": 5.764071644367601,
"density_atomic": 0.06746717832137292,
"volume": 296.4404395976377,
"volume_molar": 8.926030271066262,
"formula_full": "Sr4 Sm2 Nb2 O12",
"formula_reduced": "Sr2SmNbO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 2.1117011895,
"spacegroup": 14
},
{
"id": "jvasp-52286",
"created_at": "2022-09-04T14:37:02.549694Z",
"updated_at": "2022-09-04T14:37:02.549720Z",
"structure_string": "Li4 Si4 Bi4 O16\n1.0\n4.887072 0.000000 0.000000\n-0.000000 6.824104 0.000000\n0.000000 0.000000 10.667337\nLi Si Bi O\n4 4 4 16\ndirect\n0.000000 0.000000 0.000000 Li\n0.000000 0.500000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.500000 0.000000 0.500000 Li\n0.887898 0.750000 0.578164 Si\n0.612101 0.750000 0.078164 Si\n0.387898 0.250000 0.921836 Si\n0.112101 0.250000 0.421836 Si\n0.064182 0.750000 0.279960 Bi\n0.435817 0.750000 0.779961 Bi\n0.564182 0.250000 0.220040 Bi\n0.935817 0.250000 0.720040 Bi\n0.253015 0.062931 0.343583 O\n0.280587 0.750000 0.072585 O\n0.219413 0.750000 0.572585 O\n0.246985 0.062931 0.843583 O\n0.246985 0.437069 0.843583 O\n0.246111 0.250000 0.062411 O\n0.753889 0.750000 0.937589 O\n0.746985 0.937068 0.656417 O\n0.753014 0.562931 0.156417 O\n0.780586 0.250000 0.427415 O\n0.719413 0.250000 0.927415 O\n0.746985 0.562931 0.656417 O\n0.253015 0.437069 0.343583 O\n0.746110 0.750000 0.437589 O\n0.753014 0.937068 0.156417 O\n0.253889 0.250000 0.562411 O\n",
"nsites": 28,
"nelements": 4,
"elements": [
"Li",
"Si",
"Bi",
"O"
],
"chemical_system": "Bi-Li-O-Si",
"density": 5.750634436419203,
"density_atomic": 0.0787059638192664,
"volume": 355.7544897651821,
"volume_molar": 7.651441476313949,
"formula_full": "Li4 Si4 Bi4 O16",
"formula_reduced": "LiSiBiO4",
"formula_anonymous": "ABCD4",
"energy_above_hull": 2.0168181285714284,
"spacegroup": 62
},
{
"id": "jvasp-104901",
"created_at": "2022-09-04T14:36:46.457463Z",
"updated_at": "2022-09-04T14:36:46.457490Z",
"structure_string": "Tm2 Mn4 Si2 C2\n1.0\n5.566879 -0.000249 0.000000\n-4.369823 3.448883 0.000000\n-0.000000 -0.000000 6.937385\nTm Mn Si C\n2 4 2 2\ndirect\n0.542661 0.457338 0.250000 Tm\n0.457339 0.542661 0.750001 Tm\n0.831742 0.168258 0.060979 Mn\n0.168258 0.831741 0.939022 Mn\n0.168258 0.831741 0.560979 Mn\n0.831742 0.168258 0.439022 Mn\n0.263941 0.736059 0.250000 Si\n0.736059 0.263941 0.750001 Si\n0.000000 0.000000 0.000000 C\n0.000000 0.000000 0.500000 C\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Tm",
"Mn",
"Si",
"C"
],
"chemical_system": "C-Mn-Si-Tm",
"density": 7.95208543457558,
"density_atomic": 0.07508247376442498,
"volume": 133.18687436132566,
"volume_molar": 8.020701047883383,
"formula_full": "Tm2 Mn4 Si2 C2",
"formula_reduced": "TmMn2SiC",
"formula_anonymous": "ABCD2",
"energy_above_hull": 3.936043466551725,
"spacegroup": 63
},
{
"id": "jvasp-101927",
"created_at": "2022-09-04T14:36:54.264575Z",
"updated_at": "2022-09-04T14:36:54.264596Z",
"structure_string": "Zn1 H20 C12 O4\n1.0\n3.902886 -0.069655 0.102818\n2.059086 4.228750 0.913827\n-0.661749 0.085229 17.312259\nZn H C O\n1 20 12 4\ndirect\n0.725506 0.084406 0.846454 Zn\n0.153416 0.628489 0.539317 H\n0.015549 0.006910 0.632318 H\n0.274896 0.789047 0.029135 H\n0.142885 0.507365 0.189940 H\n0.517107 0.615739 0.170751 H\n0.406372 0.355710 0.339962 H\n0.784453 0.451448 0.313810 H\n0.695282 0.188432 0.486466 H\n0.073698 0.279959 0.457723 H\n0.930256 0.645734 0.032807 H\n0.397430 0.088530 0.600550 H\n0.395593 0.113097 0.101181 H\n0.774088 0.215710 0.084896 H\n0.605724 0.960589 0.251585 H\n-0.013027 0.052993 0.226832 H\n0.869355 0.799648 0.396591 H\n0.248200 0.890453 0.368440 H\n0.457136 0.439413 0.681569 H\n0.836267 0.504407 0.644517 H\n0.532341 0.713805 0.508330 H\n0.321511 0.500241 0.947365 C\n0.235620 0.574783 0.028498 C\n0.474835 0.310122 0.097126 C\n0.440223 0.416445 0.176037 C\n0.694623 0.153547 0.243618 C\n0.696524 0.257867 0.322039 C\n0.292993 0.905458 0.609164 C\n-0.019168 0.089250 0.466412 C\n0.250826 0.816595 0.530112 C\n0.564618 0.619745 0.669201 C\n0.670738 0.675524 0.747593 C\n-0.039143 0.991182 0.387723 C\n0.221045 0.723788 0.887705 O\n0.852713 0.440347 0.802809 O\n0.586543 0.959195 0.753312 O\n0.505796 0.211116 0.943197 O\n",
"nsites": 37,
"nelements": 4,
"elements": [
"Zn",
"H",
"C",
"O"
],
"chemical_system": "C-H-O-Zn",
"density": 1.6918750904441513,
"density_atomic": 0.12835894663795974,
"volume": 288.25415733863576,
"volume_molar": 4.691640838239058,
"formula_full": "Zn1 H20 C12 O4",
"formula_reduced": "ZnH20(C3O)4",
"formula_anonymous": "AB4C12D20",
"energy_above_hull": 4.606565254054054,
"spacegroup": 1
},
{
"id": "jvasp-43162",
"created_at": "2022-09-04T14:36:55.906871Z",
"updated_at": "2022-09-04T14:36:55.906893Z",
"structure_string": "Li2 V1 Co3 O8\n1.0\n-2.878598 1.661960 4.700732\n-0.000000 3.323919 -4.700732\n-2.742975 -1.583658 -4.645363\nLi V Co O\n2 1 3 8\ndirect\n0.877129 0.122871 0.631385 Li\n0.122872 0.877128 0.368616 Li\n0.500001 0.500000 0.500000 V\n0.500000 0.500000 0.000000 Co\n0.500000 0.000000 0.000000 Co\n0.000000 0.500000 -0.000000 Co\n0.737915 0.715767 0.760061 O\n0.737915 0.262086 0.760061 O\n0.263940 0.736060 0.791818 O\n0.284233 0.262086 0.760061 O\n0.715768 0.737914 0.239940 O\n0.736061 0.263939 0.208183 O\n0.262086 0.737914 0.239940 O\n0.262086 0.284232 0.239940 O\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Li",
"V",
"Co",
"O"
],
"chemical_system": "Co-Li-O-V",
"density": 4.715286976865102,
"density_atomic": 0.10755574679322329,
"volume": 130.16505781801789,
"volume_molar": 5.599087858668873,
"formula_full": "Li2 V1 Co3 O8",
"formula_reduced": "Li2VCo3O8",
"formula_anonymous": "AB2C3D8",
"energy_above_hull": 2.9523624928571426,
"spacegroup": 166
},
{
"id": "jvasp-104645",
"created_at": "2022-09-04T14:36:54.269433Z",
"updated_at": "2022-09-04T14:36:54.269452Z",
"structure_string": "Ba2 Ag1 I1 O6\n1.0\n5.211018 -0.000000 3.008583\n1.737006 4.912995 3.008583\n-0.000000 -0.000000 6.017166\nBa Ag I O\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.749999 Ba\n0.500000 0.500000 0.499999 Ag\n0.000000 0.000000 0.000000 I\n0.772873 0.227127 0.227127 O\n0.227128 0.772874 0.772872 O\n0.227128 0.772874 0.227126 O\n0.772873 0.227127 0.772873 O\n0.227127 0.227127 0.772873 O\n0.772873 0.772874 0.227126 O\n",
"nsites": 10,
"nelements": 4,
"elements": [
"Ba",
"Ag",
"I",
"O"
],
"chemical_system": "Ag-Ba-I-O",
"density": 6.526001587825732,
"density_atomic": 0.0649141106820582,
"volume": 154.04971114799434,
"volume_molar": 9.27709044570563,
"formula_full": "Ba2 Ag1 I1 O6",
"formula_reduced": "Ba2AgIO6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 1.4376746474999995,
"spacegroup": 225
}
]
}