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=3408",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3406",
"results": [
{
"id": "jvasp-93683",
"created_at": "2022-09-04T14:35:49.890047Z",
"updated_at": "2022-09-04T14:35:49.890072Z",
"structure_string": "Ce2 Mn1 N3\n1.0\n-0.000000 -3.448236 -0.000000\n-3.767577 0.000000 0.000000\n1.883789 1.724118 -6.214641\nCe Mn N\n2 1 3\ndirect\n0.354366 0.354366 0.708731 Ce\n0.645635 0.645635 0.291268 Ce\n0.000000 0.000000 0.000000 Mn\n0.000000 0.500000 0.000000 N\n0.163324 0.163324 0.326648 N\n0.836676 0.836676 0.673352 N\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ce",
"Mn",
"N"
],
"chemical_system": "Ce-Mn-N",
"density": 7.757723030576334,
"density_atomic": 0.07431493219426914,
"volume": 80.73747526695173,
"volume_molar": 8.103540677743364,
"formula_full": "Ce2 Mn1 N3",
"formula_reduced": "Ce2MnN3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 4.214299665229885,
"spacegroup": 71
},
{
"id": "jvasp-42743",
"created_at": "2022-09-04T14:36:00.900258Z",
"updated_at": "2022-09-04T14:36:00.900283Z",
"structure_string": "Co8 O12 F4\n1.0\n0.000000 0.000000 -5.828525\n4.477552 4.477552 0.000000\n4.263230 -4.263230 2.914262\nCo O F\n8 12 4\ndirect\n0.000507 0.973601 0.001015 Co\n0.500507 0.026399 0.001015 Co\n0.500587 -0.000000 0.501174 Co\n0.749412 0.500000 0.998826 Co\n0.249413 0.500000 0.998826 Co\n0.000588 -0.000000 0.501174 Co\n0.249493 0.473601 0.498985 Co\n0.749492 0.526399 0.498985 Co\n0.751662 0.815161 0.503324 O\n0.597421 0.500000 0.694844 O\n0.097422 0.500000 0.694844 O\n0.652578 -0.000000 0.805155 O\n0.901818 0.500000 0.303638 O\n0.152578 -0.000000 0.805155 O\n0.251662 0.184839 0.503324 O\n0.998338 0.684838 0.996676 O\n0.498338 0.315161 0.996676 O\n0.848181 -0.000000 0.196362 O\n0.348181 -0.000000 0.196362 O\n0.401818 0.500000 0.303638 O\n0.501447 0.718852 0.002896 F\n0.001448 0.281147 0.002896 F\n0.748552 0.218853 0.497104 F\n0.248552 0.781147 0.497104 F\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.518118321876985,
"density_atomic": 0.10785571963625029,
"volume": 222.51949253077538,
"volume_molar": 5.583515441100408,
"formula_full": "Co8 O12 F4",
"formula_reduced": "Co2O3F",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.3119504304166667,
"spacegroup": 64
},
{
"id": "jvasp-61494",
"created_at": "2022-09-04T14:35:54.674306Z",
"updated_at": "2022-09-04T14:35:54.674331Z",
"structure_string": "Tb1 B2 Ir3\n1.0\n4.734297 2.733240 -0.026184\n-4.734297 2.733240 -0.026184\n0.000000 0.030448 3.173029\nTb B Ir\n1 2 3\ndirect\n0.500000 0.500000 0.500002 Tb\n0.166675 0.833325 0.500002 B\n0.833325 0.166675 0.500002 B\n0.000000 0.000000 0.000000 Ir\n0.500000 -0.000000 0.000001 Ir\n-0.000000 0.500000 0.000001 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"B",
"Ir"
],
"chemical_system": "B-Ir-Tb",
"density": 15.310223500450421,
"density_atomic": 0.07305905065849772,
"volume": 82.12534854916188,
"volume_molar": 8.242840148785245,
"formula_full": "Tb1 B2 Ir3",
"formula_reduced": "TbB2Ir3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 4.3729961444444445,
"spacegroup": 191
},
{
"id": "jvasp-87010",
"created_at": "2022-09-04T14:35:52.591300Z",
"updated_at": "2022-09-04T14:35:52.591312Z",
"structure_string": "U4 Al2 Cu6\n1.0\n5.460664 -0.000000 0.000000\n-2.730332 4.729074 0.000000\n-0.000000 0.000000 7.824198\nU Al Cu\n4 2 6\ndirect\n0.333333 0.666666 0.420219 U\n0.666667 0.333333 0.920219 U\n0.666667 0.333333 0.579782 U\n0.333333 0.666666 0.079781 U\n0.000000 0.000000 0.500000 Al\n0.000000 0.000000 0.000000 Al\n0.172339 0.827660 0.750000 Cu\n0.344678 0.172339 0.250000 Cu\n0.827661 0.172339 0.250000 Cu\n0.655321 0.827660 0.750000 Cu\n0.172339 0.344678 0.750000 Cu\n0.827661 0.655321 0.250000 Cu\n",
"nsites": 12,
"nelements": 3,
"elements": [
"U",
"Al",
"Cu"
],
"chemical_system": "Al-Cu-U",
"density": 11.401847178415629,
"density_atomic": 0.05939089215314896,
"volume": 202.05118268060482,
"volume_molar": 10.139838856892304,
"formula_full": "U4 Al2 Cu6",
"formula_reduced": "U2AlCu3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.282851025,
"spacegroup": 194
},
{
"id": "jvasp-49959",
"created_at": "2022-09-04T14:35:47.610523Z",
"updated_at": "2022-09-04T14:35:47.610546Z",
"structure_string": "Tb1 Si2 Rh3\n1.0\n2.766056 -4.790949 0.000000\n2.766056 4.790949 0.000000\n0.000000 -0.000000 3.677280\nTb Si Rh\n1 2 3\ndirect\n0.000000 0.000000 0.000000 Tb\n0.666668 0.333334 0.000000 Si\n0.333334 0.666668 0.000000 Si\n0.500001 0.500001 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Tb",
"Si",
"Rh"
],
"chemical_system": "Rh-Si-Tb",
"density": 8.92454398127499,
"density_atomic": 0.06156190336982593,
"volume": 97.46287349102418,
"volume_molar": 9.782252383950336,
"formula_full": "Tb1 Si2 Rh3",
"formula_reduced": "TbSi2Rh3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.8686391,
"spacegroup": 191
},
{
"id": "jvasp-47989",
"created_at": "2022-09-04T14:35:52.964426Z",
"updated_at": "2022-09-04T14:35:52.964453Z",
"structure_string": "Co6 O9 F3\n1.0\n4.367308 -0.108671 0.000000\n-0.108671 4.367308 0.000000\n0.000000 0.000000 8.714468\nCo O F\n6 9 3\ndirect\n0.001655 0.998346 -0.000648 Co\n0.001655 0.998346 0.333981 Co\n0.014667 0.985334 0.666667 Co\n0.528630 0.471371 0.166667 Co\n0.477568 0.522432 0.832881 Co\n0.477568 0.522432 0.500453 Co\n0.817625 0.182376 0.166667 O\n0.701143 0.690154 0.334223 O\n0.701143 0.690154 -0.000889 O\n0.684760 0.708085 0.666667 O\n0.309847 0.298858 0.334223 O\n0.309847 0.298858 -0.000889 O\n0.190214 0.809787 0.500392 O\n0.190214 0.809787 0.832942 O\n0.291916 0.315241 0.666667 O\n0.790902 0.209098 0.827558 F\n0.219751 0.780250 0.166667 F\n0.790902 0.209098 0.505776 F\n",
"nsites": 18,
"nelements": 3,
"elements": [
"Co",
"O",
"F"
],
"chemical_system": "Co-F-O",
"density": 5.543968959514411,
"density_atomic": 0.10836098954218666,
"volume": 166.11143988300617,
"volume_molar": 5.557480404565228,
"formula_full": "Co6 O9 F3",
"formula_reduced": "Co2O3F",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.3103554304166667,
"spacegroup": 38
},
{
"id": "jvasp-87060",
"created_at": "2022-09-04T14:35:49.837406Z",
"updated_at": "2022-09-04T14:35:49.837424Z",
"structure_string": "Li3 La1 P2\n1.0\n4.225491 -0.000000 0.000000\n-2.112745 3.659383 0.000000\n-0.000000 0.000000 6.879779\nLi La P\n3 1 2\ndirect\n0.000000 0.000000 0.500000 Li\n0.666666 0.333333 0.361222 Li\n0.333332 0.666667 0.638778 Li\n0.000000 0.000000 0.000000 La\n0.333332 0.666667 0.263192 P\n0.666666 0.333333 0.736808 P\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Li",
"La",
"P"
],
"chemical_system": "La-Li-P",
"density": 3.460255974794381,
"density_atomic": 0.056401637841878335,
"volume": 106.37988947804965,
"volume_molar": 10.677244474500965,
"formula_full": "Li3 La1 P2",
"formula_reduced": "Li3LaP2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.6503893333333337,
"spacegroup": 164
},
{
"id": "jvasp-94342",
"created_at": "2022-09-04T14:35:55.215551Z",
"updated_at": "2022-09-04T14:35:55.215574Z",
"structure_string": "Ca2 Co1 O3\n1.0\n3.584279 1.831769 0.098411\n3.584279 -1.831769 0.098411\n-1.164126 0.000000 -6.803556\nCa Co O\n2 1 3\ndirect\n0.859137 0.859137 0.776634 Ca\n0.140863 0.140863 0.223367 Ca\n0.500000 0.500000 0.500000 Co\n-0.000000 -0.000000 0.500000 O\n0.456052 0.456052 0.207891 O\n0.543948 0.543948 0.792110 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ca",
"Co",
"O"
],
"chemical_system": "Ca-Co-O",
"density": 3.493817716336728,
"density_atomic": 0.06747732657723711,
"volume": 88.91875692692378,
"volume_molar": 8.924687840302667,
"formula_full": "Ca2 Co1 O3",
"formula_reduced": "Ca2CoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.42095204,
"spacegroup": 12
},
{
"id": "jvasp-47963",
"created_at": "2022-09-04T14:35:49.905926Z",
"updated_at": "2022-09-04T14:35:49.905950Z",
"structure_string": "Fe4 O2 F6\n1.0\n3.099897 0.000000 0.000000\n0.000000 4.774311 0.000000\n0.000000 0.000000 9.568757\nFe O F\n4 2 6\ndirect\n0.000000 0.032821 0.135551 Fe\n0.000000 0.973812 0.633146 Fe\n0.500001 0.532820 0.864450 Fe\n0.500001 0.473812 0.366854 Fe\n0.500001 0.201111 0.222783 O\n0.000000 0.701111 0.777218 O\n0.500001 0.203750 0.719950 F\n0.000000 0.296104 0.965941 F\n0.000000 0.292402 0.483639 F\n0.000000 0.703750 0.280050 F\n0.500001 0.792402 0.516361 F\n0.500001 0.796104 0.034059 F\n",
"nsites": 12,
"nelements": 3,
"elements": [
"Fe",
"O",
"F"
],
"chemical_system": "F-Fe-O",
"density": 4.331080976257018,
"density_atomic": 0.08473595936602017,
"volume": 141.61638210957815,
"volume_molar": 7.1069482248818785,
"formula_full": "Fe4 O2 F6",
"formula_reduced": "Fe2OF3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3193808912500002,
"spacegroup": 31
},
{
"id": "jvasp-107763",
"created_at": "2022-09-04T14:35:50.058750Z",
"updated_at": "2022-09-04T14:35:50.058768Z",
"structure_string": "Er2 Al1 Fe3\n1.0\n4.461783 -0.000000 2.590590\n-2.982963 4.209584 0.000000\n0.005781 0.004096 5.127612\nEr Al Fe\n2 1 3\ndirect\n0.504999 0.752500 0.742501 Er\n0.995000 0.997499 0.007499 Er\n0.750000 0.375000 0.875000 Al\n0.250000 0.375000 0.375000 Fe\n0.250000 0.875000 0.375000 Fe\n0.750000 0.375000 0.375000 Fe\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Er",
"Al",
"Fe"
],
"chemical_system": "Al-Er-Fe",
"density": 9.130563451352018,
"density_atomic": 0.06236137831756501,
"volume": 96.21339620567704,
"volume_molar": 9.656843582470618,
"formula_full": "Er2 Al1 Fe3",
"formula_reduced": "Er2AlFe3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.6774932166666665,
"spacegroup": 166
},
{
"id": "jvasp-63406",
"created_at": "2022-09-04T14:35:47.924168Z",
"updated_at": "2022-09-04T14:35:47.924199Z",
"structure_string": "Li12 B4 N8\n1.0\n-3.284360 3.284360 5.141010\n3.284360 -3.284360 5.141010\n3.284360 3.284360 -5.141010\nLi B N\n12 4 8\ndirect\n0.476104 0.523896 0.500000 Li\n0.273896 0.726104 0.000000 Li\n0.726104 0.273896 0.000000 Li\n0.023896 0.523896 0.047793 Li\n0.124638 0.124638 0.000000 Li\n0.874638 0.374638 0.500000 Li\n0.625362 0.125362 0.500000 Li\n0.875362 0.875362 0.000000 Li\n0.273896 0.273896 0.547793 Li\n0.726104 0.726104 0.452207 Li\n0.023896 0.976104 0.500000 Li\n0.476104 0.976104 0.952207 Li\n0.353739 0.353739 0.000000 B\n0.646261 0.646261 0.000000 B\n0.396261 0.896261 0.500000 B\n0.103739 0.603739 0.500000 B\n0.553748 0.349348 0.204400 N\n0.144948 0.349348 0.795600 N\n0.099348 0.394948 0.295600 N\n0.099348 0.803748 0.704400 N\n0.605052 0.900652 0.704400 N\n0.196252 0.900652 0.295600 N\n0.650652 0.855052 0.204400 N\n0.650652 0.446252 0.795600 N\n",
"nsites": 24,
"nelements": 3,
"elements": [
"Li",
"B",
"N"
],
"chemical_system": "B-Li-N",
"density": 1.786037849147497,
"density_atomic": 0.10819353065485675,
"volume": 221.82472329663875,
"volume_molar": 5.566082115585042,
"formula_full": "Li12 B4 N8",
"formula_reduced": "Li3BN2",
"formula_anonymous": "AB2C3",
"energy_above_hull": 2.9518881805555552,
"spacegroup": 141
},
{
"id": "jvasp-85714",
"created_at": "2022-09-04T14:35:55.644104Z",
"updated_at": "2022-09-04T14:35:55.644120Z",
"structure_string": "Sr2 Co1 O3\n1.0\n2.469148 2.517180 -0.487495\n-2.469148 2.517180 0.487495\n-1.085084 0.000000 7.489728\nSr Co O\n2 1 3\ndirect\n0.657983 0.342017 0.816122 Sr\n0.342018 0.657982 0.183878 Sr\n0.000000 -0.000000 0.500000 Co\n0.500000 0.500000 0.500000 O\n0.146313 0.853687 0.792823 O\n0.853688 0.146312 0.207177 O\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Sr",
"Co",
"O"
],
"chemical_system": "Co-O-Sr",
"density": 5.180935037490134,
"density_atomic": 0.0663433373357288,
"volume": 90.43862188658298,
"volume_molar": 9.077235185690325,
"formula_full": "Sr2 Co1 O3",
"formula_reduced": "Sr2CoO3",
"formula_anonymous": "AB2C3",
"energy_above_hull": 1.3932073366666664,
"spacegroup": 139
}
]
}