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=4480",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-nelements&page=4478",
"results": [
{
"id": "jvasp-97419",
"created_at": "2022-09-04T14:36:02.224254Z",
"updated_at": "2022-09-04T14:36:02.224272Z",
"structure_string": "Sn12 O24\n1.0\n4.756146 0.000000 0.000000\n0.000000 5.826182 0.000000\n0.000000 0.000000 16.099528\nSn O\n12 24\ndirect\n0.997292 0.347031 0.416010 Sn\n0.002709 0.652969 0.583990 Sn\n0.500000 0.527610 0.250000 Sn\n0.502710 0.847030 0.416010 Sn\n0.500000 0.472389 0.750000 Sn\n0.497291 0.152969 0.583990 Sn\n0.000000 0.972389 0.750000 Sn\n0.997292 0.652969 0.916010 Sn\n0.000000 0.027611 0.250000 Sn\n0.002709 0.347031 0.083990 Sn\n0.502710 0.152969 0.916010 Sn\n0.497291 0.847030 0.083990 Sn\n0.289168 0.123188 0.028984 O\n0.210832 0.376812 0.528984 O\n0.728761 0.800379 0.305493 O\n0.771241 0.300379 0.305493 O\n0.728761 0.199620 0.805493 O\n0.271240 0.800379 0.194507 O\n0.784918 0.072823 0.138333 O\n0.215083 0.072823 0.361667 O\n0.771241 0.699620 0.805493 O\n0.289168 0.876812 0.528984 O\n0.715084 0.427177 0.638333 O\n0.284917 0.427177 0.861667 O\n0.210832 0.623188 0.028984 O\n0.710833 0.876812 0.971016 O\n0.789169 0.376812 0.971016 O\n0.715084 0.572823 0.138333 O\n0.789169 0.623188 0.471016 O\n0.228760 0.300379 0.194507 O\n0.710833 0.123188 0.471016 O\n0.784918 0.927176 0.638333 O\n0.271240 0.199620 0.694507 O\n0.215083 0.927176 0.861667 O\n0.284917 0.572823 0.361667 O\n0.228760 0.699620 0.694507 O\n",
"nsites": 36,
"nelements": 2,
"elements": [
"Sn",
"O"
],
"chemical_system": "O-Sn",
"density": 6.73157341731577,
"density_atomic": 0.08069565148689199,
"volume": 446.1206934533239,
"volume_molar": 7.462782255346464,
"formula_full": "Sn12 O24",
"formula_reduced": "SnO2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.9538195666666668,
"spacegroup": 60
},
{
"id": "jvasp-14853",
"created_at": "2022-09-04T14:35:53.845404Z",
"updated_at": "2022-09-04T14:35:53.845421Z",
"structure_string": "Sr1 Ga2\n1.0\n2.171917 -3.761871 0.000000\n2.171917 3.761871 -0.000000\n0.000000 -0.000000 4.729468\nSr Ga\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.333334 0.666668 0.500000 Ga\n0.666668 0.333334 0.500000 Ga\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Sr",
"Ga"
],
"chemical_system": "Ga-Sr",
"density": 4.878786309146115,
"density_atomic": 0.03881788277653916,
"volume": 77.2839677338906,
"volume_molar": 15.513831072826251,
"formula_full": "Sr1 Ga2",
"formula_reduced": "SrGa2",
"formula_anonymous": "AB2",
"energy_above_hull": 0.0,
"spacegroup": 191
},
{
"id": "jvasp-91777",
"created_at": "2022-09-04T14:35:58.934468Z",
"updated_at": "2022-09-04T14:35:58.934481Z",
"structure_string": "Np2 Te6\n1.0\n-4.394856 0.000000 0.000000\n0.000000 -0.000000 -4.390883\n2.197428 -12.636939 0.000000\nNp Te\n2 6\ndirect\n0.168677 0.750000 0.337353 Np\n0.831324 0.250000 0.662648 Np\n0.926449 0.750000 0.852899 Te\n0.073551 0.250000 0.147101 Te\n0.573865 0.750000 0.147729 Te\n0.426136 0.250000 0.852271 Te\n0.296290 0.750000 0.592578 Te\n0.703710 0.250000 0.407422 Te\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Np",
"Te"
],
"chemical_system": "Np-Te",
"density": 8.440968142892403,
"density_atomic": 0.03280587178105231,
"volume": 243.85878398209678,
"volume_molar": 18.356899033782753,
"formula_full": "Np2 Te6",
"formula_reduced": "NpTe3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.3107033250000004,
"spacegroup": 63
},
{
"id": "jvasp-18414",
"created_at": "2022-09-04T14:35:58.832702Z",
"updated_at": "2022-09-04T14:35:58.832728Z",
"structure_string": "Ti1 H2\n1.0\n2.738596 -0.042544 -1.498220\n-1.766042 2.571349 -0.125051\n-0.029220 0.042544 3.121492\nTi H\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.500001 0.250000 0.750000 H\n0.500002 0.750001 0.250001 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ti",
"H"
],
"chemical_system": "H-Ti",
"density": 3.806451554780709,
"density_atomic": 0.13786084765112985,
"volume": 21.761073220670955,
"volume_molar": 4.368274867451568,
"formula_full": "Ti1 H2",
"formula_reduced": "TiH2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.485919444444445,
"spacegroup": 225
},
{
"id": "jvasp-106090",
"created_at": "2022-09-04T14:36:05.707621Z",
"updated_at": "2022-09-04T14:36:05.707642Z",
"structure_string": "Er2 Se3\n1.0\n3.921419 0.000000 0.000000\n0.000000 3.921419 0.000000\n0.000000 0.000000 8.029454\nEr Se\n2 3\ndirect\n0.500000 0.000000 0.761651 Er\n0.000000 0.500000 0.238349 Er\n0.000000 0.500000 0.865616 Se\n0.500000 0.000000 0.134384 Se\n0.500000 0.500000 0.500000 Se\n",
"nsites": 5,
"nelements": 2,
"elements": [
"Er",
"Se"
],
"chemical_system": "Er-Se",
"density": 7.684494454085661,
"density_atomic": 0.04049463533993433,
"volume": 123.47314546796727,
"volume_molar": 14.8714532417611,
"formula_full": "Er2 Se3",
"formula_reduced": "Er2Se3",
"formula_anonymous": "A2B3",
"energy_above_hull": 1.09074002,
"spacegroup": 115
},
{
"id": "jvasp-92280",
"created_at": "2022-09-04T14:36:06.587741Z",
"updated_at": "2022-09-04T14:36:06.587770Z",
"structure_string": "In2 Te3\n1.0\n-2.171997 -3.762009 0.000000\n2.171997 -3.762009 0.000000\n0.000000 -2.508005 9.645483\nIn Te\n2 3\ndirect\n0.400859 0.400859 0.797425 In\n0.599142 0.599142 0.202575 In\n0.786804 0.786804 0.639589 Te\n0.213197 0.213197 0.360411 Te\n0.000000 0.000000 0.000000 Te\n",
"nsites": 5,
"nelements": 2,
"elements": [
"In",
"Te"
],
"chemical_system": "In-Te",
"density": 6.451738879736063,
"density_atomic": 0.03172027746079766,
"volume": 157.62787718926424,
"volume_molar": 18.985145282674846,
"formula_full": "In2 Te3",
"formula_reduced": "In2Te3",
"formula_anonymous": "A2B3",
"energy_above_hull": 0.3361455533333333,
"spacegroup": 166
},
{
"id": "jvasp-38226",
"created_at": "2022-09-04T14:36:07.715022Z",
"updated_at": "2022-09-04T14:36:07.715047Z",
"structure_string": "Mn2 Sn6\n1.0\n3.199216 -5.541206 -0.000000\n3.199216 5.541206 -0.000000\n-0.000000 0.000000 5.506910\nMn Sn\n2 6\ndirect\n0.333333 0.666668 0.750000 Mn\n0.666668 0.333333 0.250000 Mn\n0.657855 0.828929 0.250000 Sn\n0.171073 0.828929 0.250000 Sn\n0.171072 0.342146 0.250000 Sn\n0.342146 0.171072 0.750000 Sn\n0.828929 0.171073 0.750000 Sn\n0.828929 0.657855 0.750000 Sn\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Sn"
],
"chemical_system": "Mn-Sn",
"density": 6.992089476640183,
"density_atomic": 0.04097360284903033,
"volume": 195.24765809529796,
"volume_molar": 14.697611001377972,
"formula_full": "Mn2 Sn6",
"formula_reduced": "MnSn3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.4546305853448276,
"spacegroup": 194
},
{
"id": "jvasp-92313",
"created_at": "2022-09-04T14:36:06.411103Z",
"updated_at": "2022-09-04T14:36:06.411121Z",
"structure_string": "Sr4 Mg4\n1.0\n12.962680 0.000000 0.781972\n0.000000 3.941254 0.000000\n-2.527937 0.000000 5.517353\nSr Mg\n4 4\ndirect\n0.897565 0.499999 0.672120 Sr\n0.602434 0.000000 0.327879 Sr\n0.397565 0.000000 0.672120 Sr\n0.102435 0.499999 0.327879 Sr\n0.653314 0.499999 0.867508 Mg\n0.846686 0.000000 0.132491 Mg\n0.153314 0.000000 0.867508 Mg\n0.346686 0.499999 0.132491 Mg\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Sr",
"Mg"
],
"chemical_system": "Mg-Sr",
"density": 2.5664650918387677,
"density_atomic": 0.027617804858647337,
"volume": 289.66820646844934,
"volume_molar": 21.805283913121805,
"formula_full": "Sr4 Mg4",
"formula_reduced": "SrMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.300534705882353,
"spacegroup": 12
},
{
"id": "jvasp-99473",
"created_at": "2022-09-04T14:36:06.413435Z",
"updated_at": "2022-09-04T14:36:06.413463Z",
"structure_string": "Pm1 Sc3\n1.0\n4.303660 -0.037056 -3.732615\n-0.920272 4.204279 -3.732615\n0.030086 0.037056 5.696753\nPm Sc\n1 3\ndirect\n0.000000 0.000000 0.000000 Pm\n0.750001 0.250000 0.500001 Sc\n0.250001 0.750000 0.500001 Sc\n0.500000 0.500000 0.000001 Sc\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Pm",
"Sc"
],
"chemical_system": "Pm-Sc",
"density": 4.465117503769862,
"density_atomic": 0.038431819989331525,
"volume": 104.08042088848198,
"volume_molar": 15.669673623762069,
"formula_full": "Pm1 Sc3",
"formula_reduced": "PmSc3",
"formula_anonymous": "AB3",
"energy_above_hull": 2.36148173125,
"spacegroup": 139
},
{
"id": "jvasp-85620",
"created_at": "2022-09-04T14:35:53.674645Z",
"updated_at": "2022-09-04T14:35:53.674672Z",
"structure_string": "Ce4 Zn12\n1.0\n4.575765 -0.000000 0.000000\n0.000000 6.497045 0.000000\n0.000000 0.000000 10.312586\nCe Zn\n4 12\ndirect\n0.750001 0.750001 0.649229 Ce\n0.250000 0.750001 0.149229 Ce\n0.250000 0.250000 0.350772 Ce\n0.750001 0.250000 0.850772 Ce\n0.250000 0.250000 0.049010 Zn\n0.250000 0.443784 0.631328 Zn\n0.750001 0.556217 0.368672 Zn\n0.750001 0.056217 0.131328 Zn\n0.250000 0.056217 0.631328 Zn\n0.250000 0.943784 0.868673 Zn\n0.750001 0.943784 0.368672 Zn\n0.750001 0.250000 0.549010 Zn\n0.750001 0.750001 0.950990 Zn\n0.750001 0.443784 0.131328 Zn\n0.250000 0.556217 0.868673 Zn\n0.250000 0.750001 0.450990 Zn\n",
"nsites": 16,
"nelements": 2,
"elements": [
"Ce",
"Zn"
],
"chemical_system": "Ce-Zn",
"density": 7.286925210757665,
"density_atomic": 0.052188259416060756,
"volume": 306.5823650573036,
"volume_molar": 11.539263480679924,
"formula_full": "Ce4 Zn12",
"formula_reduced": "CeZn3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.2736985500000002,
"spacegroup": 63
},
{
"id": "jvasp-20066",
"created_at": "2022-09-04T14:35:58.829081Z",
"updated_at": "2022-09-04T14:35:58.829101Z",
"structure_string": "Ca1 Cd1\n1.0\n3.800561 0.000000 0.000000\n-0.000000 3.800561 0.000000\n-0.000000 -0.000000 3.800561\nCa Cd\n1 1\ndirect\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.500000 Cd\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ca",
"Cd"
],
"chemical_system": "Ca-Cd",
"density": 4.612586158868807,
"density_atomic": 0.036432323808189504,
"volume": 54.89630610799596,
"volume_molar": 16.529664129319972,
"formula_full": "Ca1 Cd1",
"formula_reduced": "CaCd",
"formula_anonymous": "AB",
"energy_above_hull": 0.2334612499999999,
"spacegroup": 221
},
{
"id": "jvasp-86682",
"created_at": "2022-09-04T14:36:02.241780Z",
"updated_at": "2022-09-04T14:36:02.241812Z",
"structure_string": "Ce4 P8\n1.0\n3.999389 0.000000 -0.507881\n0.000000 6.424073 0.000000\n0.075706 0.000000 9.683091\nCe P\n4 8\ndirect\n0.216077 0.315039 0.138322 Ce\n0.783924 0.684961 0.861678 Ce\n0.283924 0.815038 0.361678 Ce\n0.716077 0.184961 0.638322 Ce\n0.209052 0.855266 0.672278 P\n0.790949 0.144734 0.327722 P\n0.149292 0.368631 0.449385 P\n0.350708 0.868631 0.050615 P\n0.709051 0.644734 0.172278 P\n0.649293 0.131368 0.949385 P\n0.850709 0.631368 0.550616 P\n0.290950 0.355266 0.827722 P\n",
"nsites": 12,
"nelements": 2,
"elements": [
"Ce",
"P"
],
"chemical_system": "Ce-P",
"density": 5.389492933493165,
"density_atomic": 0.04818724988940213,
"volume": 249.02852990245395,
"volume_molar": 12.49737383607039,
"formula_full": "Ce4 P8",
"formula_reduced": "CeP2",
"formula_anonymous": "AB2",
"energy_above_hull": 2.0464488333333337,
"spacegroup": 14
}
]
}