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=588",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=586",
"results": [
{
"id": "jvasp-78464",
"created_at": "2022-09-04T14:37:09.962220Z",
"updated_at": "2022-09-04T14:37:09.962239Z",
"structure_string": "Ti1 Al1\n1.0\n2.818663 0.000000 -0.000000\n-0.000000 2.818663 -0.000000\n0.000000 0.000000 4.090006\nTi Al\n1 1\ndirect\n0.000000 0.000000 0.000000 Ti\n0.499999 0.499999 0.500000 Al\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ti",
"Al"
],
"chemical_system": "Al-Ti",
"density": 3.824918346458207,
"density_atomic": 0.0615488214377452,
"volume": 32.49452959912385,
"volume_molar": 9.78433155879551,
"formula_full": "Ti1 Al1",
"formula_reduced": "TiAl",
"formula_anonymous": "AB",
"energy_above_hull": 1.6310905666666673,
"spacegroup": 123
},
{
"id": "jvasp-79816",
"created_at": "2022-09-04T14:37:15.895683Z",
"updated_at": "2022-09-04T14:37:15.895712Z",
"structure_string": "Fe2 S2\n1.0\n3.338378 -0.000000 -0.000000\n-1.669190 2.891120 0.000000\n-0.000000 0.000000 5.113478\nFe S\n2 2\ndirect\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.666667 0.333333 0.750000 S\n0.333333 0.666667 0.250000 S\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Fe",
"S"
],
"chemical_system": "Fe-S",
"density": 5.91560753749056,
"density_atomic": 0.0810479383096263,
"volume": 49.353507114750485,
"volume_molar": 7.4303441711172225,
"formula_full": "Fe2 S2",
"formula_reduced": "FeS",
"formula_anonymous": "AB",
"energy_above_hull": 1.6018927499999995,
"spacegroup": 194
},
{
"id": "jvasp-29376",
"created_at": "2022-09-04T14:37:07.412734Z",
"updated_at": "2022-09-04T14:37:07.412754Z",
"structure_string": "Pb4 O4\n1.0\n5.961250 -0.001342 0.000442\n-0.001141 5.556011 0.000275\n0.000466 0.000171 4.813886\nPb O\n4 4\ndirect\n0.729471 0.510768 0.190052 Pb\n0.270532 0.010582 0.190184 Pb\n0.270529 0.489232 0.690191 Pb\n0.729469 0.989420 0.690059 Pb\n0.638672 0.911475 0.190327 O\n0.361316 0.411364 0.190432 O\n0.638684 0.588634 0.690324 O\n0.361329 0.088526 0.690427 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Pb",
"O"
],
"chemical_system": "O-Pb",
"density": 9.298350266048665,
"density_atomic": 0.050175738964602534,
"volume": 159.43960497809027,
"volume_molar": 12.002096798710706,
"formula_full": "Pb4 O4",
"formula_reduced": "PbO",
"formula_anonymous": "AB",
"energy_above_hull": 0.2702571599999999,
"spacegroup": 57
},
{
"id": "jvasp-78538",
"created_at": "2022-09-04T14:37:15.882857Z",
"updated_at": "2022-09-04T14:37:15.882877Z",
"structure_string": "Rb2 Bi2\n1.0\n0.000000 0.000000 -3.329568\n0.000000 -6.966557 0.000000\n-6.966544 0.000000 0.000000\nRb Bi\n2 2\ndirect\n0.500219 0.000000 0.500000 Rb\n0.499782 0.500000 0.000000 Rb\n0.999763 0.500000 0.500000 Bi\n0.000237 0.000000 0.000000 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Rb",
"Bi"
],
"chemical_system": "Bi-Rb",
"density": 6.051520776770842,
"density_atomic": 0.02475349480307403,
"volume": 161.59334396302123,
"volume_molar": 24.32844658061025,
"formula_full": "Rb2 Bi2",
"formula_reduced": "RbBi",
"formula_anonymous": "AB",
"energy_above_hull": 0.2591297666666667,
"spacegroup": 123
},
{
"id": "jvasp-78807",
"created_at": "2022-09-04T14:37:10.037159Z",
"updated_at": "2022-09-04T14:37:10.037180Z",
"structure_string": "Ca2 Mg2\n1.0\n5.545866 0.000000 0.000000\n0.000000 5.558475 0.000000\n0.000000 0.000000 3.964534\nCa Mg\n2 2\ndirect\n0.000000 0.000000 -0.000032 Ca\n0.500000 0.500000 0.000032 Ca\n0.500000 0.000000 0.500001 Mg\n0.000000 0.500000 0.499998 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg",
"density": 1.7495772669638308,
"density_atomic": 0.032729759643984814,
"volume": 122.21293536859606,
"volume_molar": 18.399587487061698,
"formula_full": "Ca2 Mg2",
"formula_reduced": "CaMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.2156265,
"spacegroup": 221
},
{
"id": "jvasp-78569",
"created_at": "2022-09-04T14:37:15.874517Z",
"updated_at": "2022-09-04T14:37:15.874540Z",
"structure_string": "Ca2 Mg2\n1.0\n5.573274 0.000000 0.000000\n0.000000 3.929295 0.000000\n-0.000000 0.000000 5.573738\nCa Mg\n2 2\ndirect\n0.749999 0.499999 0.250111 Ca\n0.250000 0.499999 0.749889 Ca\n0.749999 0.000000 0.750137 Mg\n0.250000 0.000000 0.249863 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Mg"
],
"chemical_system": "Ca-Mg",
"density": 1.7517766031250526,
"density_atomic": 0.032770903150643446,
"volume": 122.05949837917302,
"volume_molar": 18.376487008359295,
"formula_full": "Ca2 Mg2",
"formula_reduced": "CaMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.2141515,
"spacegroup": 221
},
{
"id": "jvasp-7701",
"created_at": "2022-09-04T14:37:04.947012Z",
"updated_at": "2022-09-04T14:37:04.947033Z",
"structure_string": "Tb1 Au1\n1.0\n3.593382 0.000000 0.000000\n-0.000000 3.593382 0.000000\n-0.000000 -0.000000 3.593382\nTb Au\n1 1\ndirect\n0.500000 0.500000 0.500000 Tb\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Tb",
"Au"
],
"chemical_system": "Au-Tb",
"density": 12.736704128549773,
"density_atomic": 0.04310422407040184,
"volume": 46.39916488772454,
"volume_molar": 13.971115105016338,
"formula_full": "Tb1 Au1",
"formula_reduced": "TbAu",
"formula_anonymous": "AB",
"energy_above_hull": 0.1581679849999999,
"spacegroup": 221
},
{
"id": "jvasp-80517",
"created_at": "2022-09-04T14:37:15.868090Z",
"updated_at": "2022-09-04T14:37:15.868099Z",
"structure_string": "Y2 Mg2\n1.0\n3.440310 0.000000 -0.000000\n-1.720155 2.979397 0.000000\n0.000000 -0.000000 11.012001\nY Mg\n2 2\ndirect\n0.666667 0.333333 0.868268 Y\n0.333332 0.666668 0.131732 Y\n0.333332 0.666668 0.615680 Mg\n0.666667 0.333333 0.384320 Mg\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Y",
"Mg"
],
"chemical_system": "Mg-Y",
"density": 3.3310024196575996,
"density_atomic": 0.03543788506138923,
"volume": 112.87355306533614,
"volume_molar": 16.99351061601959,
"formula_full": "Y2 Mg2",
"formula_reduced": "YMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.9561401928571428,
"spacegroup": 164
},
{
"id": "jvasp-7702",
"created_at": "2022-09-04T14:37:06.857569Z",
"updated_at": "2022-09-04T14:37:06.857599Z",
"structure_string": "Ti1 Au1\n1.0\n3.263150 0.000000 -0.000000\n0.000000 3.263150 0.000000\n0.000000 -0.000000 3.263150\nTi Au\n1 1\ndirect\n0.500000 0.500000 0.500000 Ti\n0.000000 0.000000 0.000000 Au\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ti",
"Au"
],
"chemical_system": "Au-Ti",
"density": 11.700621949995151,
"density_atomic": 0.0575597477703451,
"volume": 34.74650389330587,
"volume_molar": 10.462416868168798,
"formula_full": "Ti1 Au1",
"formula_reduced": "TiAu",
"formula_anonymous": "AB",
"energy_above_hull": 1.2471979516666667,
"spacegroup": 221
},
{
"id": "jvasp-78799",
"created_at": "2022-09-04T14:37:15.837702Z",
"updated_at": "2022-09-04T14:37:15.837720Z",
"structure_string": "Ca2 Zn2\n1.0\n5.158484 0.000000 -0.000000\n0.000000 3.659087 0.000000\n0.000000 0.000000 5.159062\nCa Zn\n2 2\ndirect\n0.749999 0.000000 0.250001 Ca\n0.250000 0.000000 0.749999 Ca\n0.250000 0.500000 0.249900 Zn\n0.749999 0.500000 0.750100 Zn\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ca",
"Zn"
],
"chemical_system": "Ca-Zn",
"density": 3.5975965987790777,
"density_atomic": 0.04107659355756044,
"volume": 97.3790583290413,
"volume_molar": 14.66075990834343,
"formula_full": "Ca2 Zn2",
"formula_reduced": "CaZn",
"formula_anonymous": "AB",
"energy_above_hull": 0.3484686363636363,
"spacegroup": 221
},
{
"id": "jvasp-78282",
"created_at": "2022-09-04T14:37:09.674605Z",
"updated_at": "2022-09-04T14:37:09.674621Z",
"structure_string": "La1 Te1\n1.0\n3.936291 -0.000000 -0.000000\n-0.000000 3.936291 -0.000000\n0.000000 0.000000 3.936291\nLa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Te\n",
"nsites": 2,
"nelements": 2,
"elements": [
"La",
"Te"
],
"chemical_system": "La-Te",
"density": 7.255939168322263,
"density_atomic": 0.032792037651410685,
"volume": 60.990415455745904,
"volume_molar": 18.36464334426907,
"formula_full": "La1 Te1",
"formula_reduced": "LaTe",
"formula_anonymous": "AB",
"energy_above_hull": 0.1732663833333332,
"spacegroup": 221
},
{
"id": "jvasp-78564",
"created_at": "2022-09-04T14:37:10.314386Z",
"updated_at": "2022-09-04T14:37:10.314417Z",
"structure_string": "Hf1 Mg1\n1.0\n3.053337 0.000000 -0.000000\n0.000000 3.053337 -0.000000\n-0.000000 -0.000000 4.576470\nHf Mg\n1 1\ndirect\n0.000000 0.000000 0.000000 Hf\n0.500001 0.500001 0.500000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Hf",
"Mg"
],
"chemical_system": "Hf-Mg",
"density": 7.8927117059241665,
"density_atomic": 0.04687592976907789,
"volume": 42.665820386976456,
"volume_molar": 12.846978800562495,
"formula_full": "Hf1 Mg1",
"formula_reduced": "HfMg",
"formula_anonymous": "AB",
"energy_above_hull": 1.6665777142857146,
"spacegroup": 123
}
]
}