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=3379",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nelements&page=3377",
"results": [
{
"id": "jvasp-48817",
"created_at": "2022-09-04T14:35:43.834982Z",
"updated_at": "2022-09-04T14:35:43.835011Z",
"structure_string": "Fe4 O2 F6\n1.0\n-0.132598 4.657010 2.981537\n-0.132598 4.657010 -2.981537\n-4.657010 0.132598 -2.981537\nFe O F\n4 2 6\ndirect\n0.750000 0.750000 0.500001 Fe\n0.250000 0.250000 0.500000 Fe\n-0.000000 0.972949 0.027052 Fe\n0.500000 0.527052 0.972949 Fe\n0.500000 0.808902 0.691099 O\n-0.000000 0.691098 0.308902 O\n0.563188 0.250000 0.813188 F\n0.063188 0.750001 0.813188 F\n-0.000000 0.278319 0.721682 F\n0.500000 0.221682 0.278318 F\n0.936812 0.250000 0.186813 F\n0.436812 0.750000 0.186813 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.746543702418523,
"density_atomic": 0.09286433029122544,
"volume": 129.220767138121,
"volume_molar": 6.484880406841225,
"formula_full": "Fe4 O2 F6",
"formula_reduced": "Fe2OF3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3411408912500002,
"spacegroup": 74
},
{
"id": "jvasp-75655",
"created_at": "2022-09-04T14:35:43.844903Z",
"updated_at": "2022-09-04T14:35:43.844930Z",
"structure_string": "Na1 Mo2 As1\n1.0\n-0.000000 3.169430 3.169430\n3.169430 -0.000000 3.169430\n3.169430 3.169430 0.000000\nNa Mo As\n1 2 1\ndirect\n0.750000 0.750000 0.750000 Na\n0.000000 0.000000 0.000000 Mo\n0.250000 0.250000 0.250000 Mo\n0.500000 0.500000 0.500000 As\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Mo",
"As"
],
"chemical_system": "As-Mo-Na",
"density": 7.557202430427727,
"density_atomic": 0.06281834675290762,
"volume": 63.67566494122763,
"volume_molar": 9.586595431566748,
"formula_full": "Na1 Mo2 As1",
"formula_reduced": "NaMo2As",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.4899831375000003,
"spacegroup": 216
},
{
"id": "jvasp-50807",
"created_at": "2022-09-04T14:35:43.852060Z",
"updated_at": "2022-09-04T14:35:43.852094Z",
"structure_string": "Ho6 Re1 O12\n1.0\n4.880189 2.817580 3.096967\n-4.880190 2.817579 3.096967\n0.000000 -5.635158 3.096967\nHo Re O\n6 1 12\ndirect\n0.389040 0.856301 0.685233 Ho\n0.314768 0.610961 0.143700 Ho\n0.143700 0.314768 0.610961 Ho\n0.856301 0.685233 0.389040 Ho\n0.685233 0.389040 0.856301 Ho\n0.610961 0.143700 0.314768 Ho\n0.000000 0.000000 0.000000 Re\n0.822761 0.410496 0.567860 O\n0.432142 0.177240 0.589505 O\n0.926056 0.702058 0.035576 O\n0.589505 0.432141 0.177240 O\n0.410496 0.567859 0.822761 O\n0.177240 0.589505 0.432141 O\n0.567860 0.822761 0.410496 O\n0.702058 0.035576 0.926056 O\n0.297943 0.964426 0.073945 O\n0.035576 0.926056 0.702058 O\n0.073945 0.297943 0.964426 O\n0.964426 0.073945 0.297943 O\n",
"nsites": 19,
"nelements": 3,
"elements": [
"Ho",
"Re",
"O"
],
"chemical_system": "Ho-O-Re",
"density": 8.889252672131835,
"density_atomic": 0.07436232488648772,
"volume": 255.50572859311535,
"volume_molar": 8.098376118811037,
"formula_full": "Ho6 Re1 O12",
"formula_reduced": "Ho6ReO12",
"formula_anonymous": "AB6C12",
"energy_above_hull": 2.75650807368421,
"spacegroup": 148
},
{
"id": "jvasp-70872",
"created_at": "2022-09-04T14:35:43.853080Z",
"updated_at": "2022-09-04T14:35:43.853097Z",
"structure_string": "Y1 Be1 Mo4\n1.0\n-0.000000 3.772319 3.772319\n3.772319 -0.000000 3.772319\n3.772319 3.772319 -0.000000\nY Be Mo\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Y\n0.000000 0.000000 0.000000 Be\n0.122514 0.625829 0.625829 Mo\n0.625829 0.625829 0.625829 Mo\n0.625829 0.122514 0.625829 Mo\n0.625829 0.625829 0.122514 Mo\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Y",
"Be",
"Mo"
],
"chemical_system": "Be-Mo-Y",
"density": 7.44990455061094,
"density_atomic": 0.055885098618549164,
"volume": 107.36314596049587,
"volume_molar": 10.775932956842192,
"formula_full": "Y1 Be1 Mo4",
"formula_reduced": "YBeMo4",
"formula_anonymous": "ABC4",
"energy_above_hull": 5.381367525000001,
"spacegroup": 216
},
{
"id": "jvasp-74359",
"created_at": "2022-09-04T14:35:43.860871Z",
"updated_at": "2022-09-04T14:35:43.860896Z",
"structure_string": "Sc1 Be1 Pb2\n1.0\n4.632494 0.000000 0.000000\n0.000000 4.632494 -0.000000\n0.000000 0.000000 4.129307\nSc Be Pb\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Sc\n0.000000 0.000000 0.500000 Be\n0.500000 0.000000 0.000000 Pb\n0.000000 0.500000 0.000000 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Be",
"Pb"
],
"chemical_system": "Be-Pb-Sc",
"density": 8.77666448912978,
"density_atomic": 0.04513911998036173,
"volume": 88.61493094549128,
"volume_molar": 13.341289689785711,
"formula_full": "Sc1 Be1 Pb2",
"formula_reduced": "ScBePb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2684182474999997,
"spacegroup": 123
},
{
"id": "jvasp-91603",
"created_at": "2022-09-04T14:35:43.879589Z",
"updated_at": "2022-09-04T14:35:43.879598Z",
"structure_string": "Tb2 Co2 Ge4\n1.0\n-0.000000 -0.000000 -4.179628\n-4.142857 -0.000000 -0.000000\n2.071429 8.267895 0.000000\nTb Co Ge\n2 2 4\ndirect\n0.750000 0.109187 0.218373 Tb\n0.250000 0.890814 0.781627 Tb\n0.750000 0.318846 0.637690 Co\n0.250000 0.681155 0.362311 Co\n0.750000 0.455388 0.910776 Ge\n0.250000 0.544613 0.089225 Ge\n0.750000 0.749179 0.498356 Ge\n0.250000 0.250822 0.501644 Ge\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Tb",
"Co",
"Ge"
],
"chemical_system": "Co-Ge-Tb",
"density": 8.424010836873888,
"density_atomic": 0.055880136922343344,
"volume": 143.16357189885923,
"volume_molar": 10.776889770991383,
"formula_full": "Tb2 Co2 Ge4",
"formula_reduced": "TbCoGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.4150102999999998,
"spacegroup": 63
},
{
"id": "jvasp-63911",
"created_at": "2022-09-04T14:35:43.881225Z",
"updated_at": "2022-09-04T14:35:43.881243Z",
"structure_string": "K1 Ba1 Pb1\n1.0\n0.000000 4.107954 4.107954\n4.107954 0.000000 4.107954\n4.107954 4.107954 -0.000000\nK Ba Pb\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Pb\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Ba",
"Pb"
],
"chemical_system": "Ba-K-Pb",
"density": 4.594620303874857,
"density_atomic": 0.021637871812612723,
"volume": 138.64579779289102,
"volume_molar": 27.83148366970957,
"formula_full": "K1 Ba1 Pb1",
"formula_reduced": "KBaPb",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0292344649999999,
"spacegroup": 216
},
{
"id": "jvasp-69067",
"created_at": "2022-09-04T14:35:43.884339Z",
"updated_at": "2022-09-04T14:35:43.884376Z",
"structure_string": "Ba1 La1 Ti4\n1.0\n0.000000 4.253864 4.253864\n4.253864 -0.000000 4.253864\n4.253864 4.253864 0.000000\nBa La Ti\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 La\n0.086885 0.637705 0.637705 Ti\n0.637705 0.637705 0.637705 Ti\n0.637705 0.086885 0.637705 Ti\n0.637705 0.637705 0.086885 Ti\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"La",
"Ti"
],
"chemical_system": "Ba-La-Ti",
"density": 5.044708835129466,
"density_atomic": 0.038973593559395746,
"volume": 153.9503918430309,
"volume_molar": 15.451848828931467,
"formula_full": "Ba1 La1 Ti4",
"formula_reduced": "BaLaTi4",
"formula_anonymous": "ABC4",
"energy_above_hull": 3.224257383888889,
"spacegroup": 216
},
{
"id": "jvasp-12152",
"created_at": "2022-09-04T14:35:43.887366Z",
"updated_at": "2022-09-04T14:35:43.887396Z",
"structure_string": "Zr1 Mo2 O8\n1.0\n4.469426 -0.105698 0.013337\n0.116023 5.425416 2.990657\n-0.018935 0.123036 6.194928\nZr Mo O\n1 2 8\ndirect\n0.000000 0.000000 0.000000 Zr\n0.838343 0.333295 0.333295 Mo\n0.161658 0.666706 0.666706 Mo\n0.752799 0.663309 0.168255 O\n0.247202 0.831746 0.336692 O\n0.247202 0.336692 0.831746 O\n0.247289 0.831755 0.831754 O\n0.752712 0.168246 0.168246 O\n0.222078 0.333360 0.333359 O\n0.777923 0.666641 0.666641 O\n0.752799 0.168255 0.663309 O\n",
"nsites": 11,
"nelements": 3,
"elements": [
"Zr",
"Mo",
"O"
],
"chemical_system": "Mo-O-Zr",
"density": 4.592100955323859,
"density_atomic": 0.07399602378528644,
"volume": 148.6566363608752,
"volume_molar": 8.138465355212043,
"formula_full": "Zr1 Mo2 O8",
"formula_reduced": "Zr(MoO4)2",
"formula_anonymous": "AB2C8",
"energy_above_hull": 3.688724936363637,
"spacegroup": 164
},
{
"id": "jvasp-92901",
"created_at": "2022-09-04T14:35:43.894051Z",
"updated_at": "2022-09-04T14:35:43.894075Z",
"structure_string": "Mg6 B1 Mo1\n1.0\n6.373276 -0.249853 0.000000\n-3.403017 5.394492 0.000000\n0.000000 0.000000 4.542207\nMg B Mo\n6 1 1\ndirect\n0.181827 0.832675 0.250000 Mg\n0.667325 0.318173 0.250000 Mg\n0.671848 0.828152 0.250000 Mg\n0.327273 0.644783 0.750000 Mg\n0.855218 0.172727 0.750000 Mg\n0.825242 0.674759 0.750000 Mg\n0.260833 0.239167 0.750000 B\n0.210434 0.289566 0.250000 Mo\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Mg",
"B",
"Mo"
],
"chemical_system": "B-Mg-Mo",
"density": 2.753879891623264,
"density_atomic": 0.05252731551215652,
"volume": 152.3017104909643,
"volume_molar": 11.464779232066945,
"formula_full": "Mg6 B1 Mo1",
"formula_reduced": "Mg6BMo",
"formula_anonymous": "ABC6",
"energy_above_hull": 0.8270503479166667,
"spacegroup": 38
},
{
"id": "jvasp-66094",
"created_at": "2022-09-04T14:35:43.897877Z",
"updated_at": "2022-09-04T14:35:43.897893Z",
"structure_string": "Ba4 Re1 Tc1\n1.0\n-0.000000 4.709327 4.709327\n4.709327 -0.000000 4.709327\n4.709327 4.709327 -0.000000\nBa Re Tc\n4 1 1\ndirect\n0.125516 0.624828 0.624828 Ba\n0.624828 0.624828 0.624828 Ba\n0.624828 0.125516 0.624828 Ba\n0.624828 0.624828 0.125516 Ba\n0.250000 0.250000 0.250000 Re\n0.000000 0.000000 0.000000 Tc\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Re",
"Tc"
],
"chemical_system": "Ba-Re-Tc",
"density": 6.626069384677307,
"density_atomic": 0.028723986395332777,
"volume": 208.8846554033639,
"volume_molar": 20.96554662405253,
"formula_full": "Ba4 Re1 Tc1",
"formula_reduced": "Ba4ReTc",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.41095723,
"spacegroup": 216
},
{
"id": "jvasp-16056",
"created_at": "2022-09-04T14:35:43.878277Z",
"updated_at": "2022-09-04T14:35:43.878303Z",
"structure_string": "Er2 Co2 C2\n1.0\n3.603631 -0.000000 0.000000\n0.000000 3.603631 0.000000\n0.000000 0.000000 6.771549\nEr Co C\n2 2 2\ndirect\n0.000000 0.000000 0.750000 Er\n0.000000 0.000000 0.250000 Er\n0.500000 0.500000 0.000000 Co\n0.500000 0.500000 0.500000 Co\n0.500000 0.000000 0.500000 C\n0.000000 0.500000 0.000000 C\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Co",
"C"
],
"chemical_system": "C-Co-Er",
"density": 8.996166289891487,
"density_atomic": 0.06823113512136236,
"volume": 87.93639427700904,
"volume_molar": 8.826089071050117,
"formula_full": "Er2 Co2 C2",
"formula_reduced": "ErCoC",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0178002999999998,
"spacegroup": 131
}
]
}