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=-spacegroup&page=381",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-spacegroup&page=379",
"results": [
{
"id": "jvasp-41296",
"created_at": "2022-09-04T14:37:33.437866Z",
"updated_at": "2022-09-04T14:37:33.437886Z",
"structure_string": "Hf1 Nb1 Tc2\n1.0\n0.000001 3.222610 3.222610\n3.222616 -0.000003 3.222615\n3.222615 3.222613 -0.000002\nHf Nb Tc\n1 1 2\ndirect\n0.250000 0.250002 0.249999 Hf\n0.750000 0.750002 0.750000 Nb\n0.500000 0.500001 0.500001 Tc\n0.000001 -0.000000 -0.000000 Tc\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Hf",
"Nb",
"Tc"
],
"chemical_system": "Hf-Nb-Tc",
"density": 11.595237411903229,
"density_atomic": 0.05975925775396931,
"volume": 66.93523564948083,
"volume_molar": 10.077335272123591,
"formula_full": "Hf1 Nb1 Tc2",
"formula_reduced": "HfNbTc2",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.35591385,
"spacegroup": 225
},
{
"id": "jvasp-56531",
"created_at": "2022-09-04T14:37:33.324900Z",
"updated_at": "2022-09-04T14:37:33.324923Z",
"structure_string": "Li2 Ga1 Ir1\n1.0\n3.592641 -0.000000 2.074213\n1.197547 3.387175 2.074213\n-0.000000 0.000000 4.148426\nLi Ga Ir\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.750001 0.749999 0.750000 Li\n0.000000 0.000000 0.000000 Ga\n0.500000 0.499999 0.500000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ga",
"Ir"
],
"chemical_system": "Ga-Ir-Li",
"density": 9.072838828993115,
"density_atomic": 0.07923648228186556,
"volume": 50.48179682902783,
"volume_molar": 7.60021215805318,
"formula_full": "Li2 Ga1 Ir1",
"formula_reduced": "Li2GaIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.3250333562499996,
"spacegroup": 225
},
{
"id": "jvasp-40939",
"created_at": "2022-09-04T14:37:33.376029Z",
"updated_at": "2022-09-04T14:37:33.376055Z",
"structure_string": "Pm2 Mg1 Al1\n1.0\n0.000000 3.753297 3.753297\n3.753297 -0.000000 3.753297\n3.753297 3.753297 -0.000000\nPm Mg Al\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Pm\n0.750001 0.750001 0.750001 Mg\n0.250001 0.250001 0.250001 Al\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Mg",
"Al"
],
"chemical_system": "Al-Mg-Pm",
"density": 5.359193838245178,
"density_atomic": 0.037826068145062515,
"volume": 105.74717902638065,
"volume_molar": 15.9206099267446,
"formula_full": "Pm2 Mg1 Al1",
"formula_reduced": "Pm2MgAl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.93205105,
"spacegroup": 225
},
{
"id": "jvasp-59628",
"created_at": "2022-09-04T14:37:33.383762Z",
"updated_at": "2022-09-04T14:37:33.383791Z",
"structure_string": "Tl3 Ir1 N6 O12\n1.0\n6.857030 -0.000000 3.958908\n2.285677 6.464870 3.958908\n-0.000000 -0.000000 7.917817\nTl Ir N O\n3 1 6 12\ndirect\n0.500000 0.500000 0.500000 Tl\n0.750000 0.750000 0.750000 Tl\n0.250000 0.250000 0.250000 Tl\n0.000000 0.000000 0.000000 Ir\n0.821224 0.821224 0.178777 N\n0.178777 0.821224 0.178776 N\n0.178776 0.178776 0.821224 N\n0.821224 0.178776 0.821224 N\n0.178777 0.821224 0.821224 N\n0.821224 0.178776 0.178777 N\n0.418371 0.000000 0.581629 O\n0.000000 0.418371 0.581629 O\n0.000000 0.000000 0.581629 O\n0.000000 0.581629 0.000000 O\n0.000000 0.581629 0.418371 O\n0.418371 0.000000 0.000000 O\n0.000000 0.418371 0.000000 O\n0.581629 0.000000 0.418372 O\n0.581629 0.418371 0.000000 O\n0.418371 0.581629 0.000000 O\n0.581629 0.000000 0.000000 O\n0.000000 0.000000 0.418371 O\n",
"nsites": 22,
"nelements": 4,
"elements": [
"Tl",
"Ir",
"N",
"O"
],
"chemical_system": "Ir-N-O-Tl",
"density": 5.116042185054358,
"density_atomic": 0.06267890130460835,
"volume": 350.9953037160607,
"volume_molar": 9.607923295804857,
"formula_full": "Tl3 Ir1 N6 O12",
"formula_reduced": "Tl3Ir(NO2)6",
"formula_anonymous": "AB3C6D12",
"energy_above_hull": 3.656840472727272,
"spacegroup": 225
},
{
"id": "jvasp-41778",
"created_at": "2022-09-04T14:37:33.390838Z",
"updated_at": "2022-09-04T14:37:33.390857Z",
"structure_string": "Ca1 Sn1 Rh2\n1.0\n-0.000000 3.293037 3.293037\n3.293037 -0.000000 3.293037\n3.293037 3.293037 0.000000\nCa Sn Rh\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ca\n0.750002 0.750002 0.750002 Sn\n0.000000 0.000000 0.000000 Rh\n0.500001 0.500001 0.500001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Sn",
"Rh"
],
"chemical_system": "Ca-Rh-Sn",
"density": 8.477049980812222,
"density_atomic": 0.05600672325667188,
"volume": 71.4199968755268,
"volume_molar": 10.752531856579566,
"formula_full": "Ca1 Sn1 Rh2",
"formula_reduced": "CaSnRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.2946095300000002,
"spacegroup": 225
},
{
"id": "jvasp-41437",
"created_at": "2022-09-04T14:37:33.406751Z",
"updated_at": "2022-09-04T14:37:33.406769Z",
"structure_string": "Lu1 Nb1 Ru2\n1.0\n0.000000 3.238197 3.238197\n3.238197 -0.000000 3.238197\n3.238197 3.238197 -0.000000\nLu Nb Ru\n1 1 2\ndirect\n0.249999 0.249999 0.249999 Lu\n0.750002 0.750002 0.750002 Nb\n0.000000 0.000000 0.000000 Ru\n0.499999 0.499999 0.499999 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Lu",
"Nb",
"Ru"
],
"chemical_system": "Lu-Nb-Ru",
"density": 11.492632640365192,
"density_atomic": 0.05890066490206491,
"volume": 67.91094814720454,
"volume_molar": 10.224232222188173,
"formula_full": "Lu1 Nb1 Ru2",
"formula_reduced": "LuNbRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.8370365375,
"spacegroup": 225
},
{
"id": "jvasp-40853",
"created_at": "2022-09-04T14:37:33.451617Z",
"updated_at": "2022-09-04T14:37:33.451644Z",
"structure_string": "Pm1 Mg1 Rh2\n1.0\n0.000000 3.328399 3.328399\n3.328399 0.000000 3.328399\n3.328399 3.328399 -0.000000\nPm Mg Rh\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Pm\n0.249999 0.249999 0.249999 Mg\n0.000000 0.000000 0.000000 Rh\n0.500001 0.500001 0.500001 Rh\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Mg",
"Rh"
],
"chemical_system": "Mg-Pm-Rh",
"density": 8.446534143347536,
"density_atomic": 0.05424052033287107,
"volume": 73.74560523114862,
"volume_molar": 11.102660378334232,
"formula_full": "Pm1 Mg1 Rh2",
"formula_reduced": "PmMgRh2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.47235155625,
"spacegroup": 225
},
{
"id": "jvasp-40943",
"created_at": "2022-09-04T14:37:33.511270Z",
"updated_at": "2022-09-04T14:37:33.511294Z",
"structure_string": "Pm2 Mg1 Tl1\n1.0\n0.000000 3.842228 3.842228\n3.842228 -0.000000 3.842228\n3.842228 3.842228 -0.000000\nPm Mg Tl\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Pm\n0.500000 0.500000 0.500000 Pm\n0.250000 0.250000 0.250000 Mg\n0.750001 0.750001 0.750001 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pm",
"Mg",
"Tl"
],
"chemical_system": "Mg-Pm-Tl",
"density": 7.592348870897553,
"density_atomic": 0.03525986116546121,
"volume": 113.44344157311087,
"volume_molar": 17.07930933630274,
"formula_full": "Pm2 Mg1 Tl1",
"formula_reduced": "Pm2MgTl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.456747821875,
"spacegroup": 225
},
{
"id": "jvasp-42110",
"created_at": "2022-09-04T14:37:33.394193Z",
"updated_at": "2022-09-04T14:37:33.394224Z",
"structure_string": "Li1 Sc2 Os1\n1.0\n0.000000 3.249495 3.249495\n3.249495 0.000000 3.249495\n3.249495 3.249495 0.000000\nLi Sc Os\n1 2 1\ndirect\n0.250000 0.250000 0.250000 Li\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 Sc\n0.750000 0.750000 0.750000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Sc",
"Os"
],
"chemical_system": "Li-Os-Sc",
"density": 6.9467023748835155,
"density_atomic": 0.0582884325170659,
"volume": 68.62425059772993,
"volume_molar": 10.331622416226093,
"formula_full": "Li1 Sc2 Os1",
"formula_reduced": "LiSc2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.859058875,
"spacegroup": 225
},
{
"id": "jvasp-41796",
"created_at": "2022-09-04T14:37:34.187115Z",
"updated_at": "2022-09-04T14:37:34.187135Z",
"structure_string": "Li1 Pm2 Ge1\n1.0\n-0.000002 3.629109 3.629108\n3.629111 -0.000005 3.629111\n3.629109 3.629110 -0.000003\nLi Pm Ge\n1 2 1\ndirect\n0.750001 0.750000 0.750000 Li\n0.000000 0.000000 0.000000 Pm\n0.500002 0.500001 0.500001 Pm\n0.249999 0.249999 0.249999 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Pm",
"Ge"
],
"chemical_system": "Ge-Li-Pm",
"density": 6.419894084818442,
"density_atomic": 0.041843607605833236,
"volume": 95.59405196798512,
"volume_molar": 14.392020919249036,
"formula_full": "Li1 Pm2 Ge1",
"formula_reduced": "LiPm2Ge",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.0581145749999998,
"spacegroup": 225
},
{
"id": "jvasp-41986",
"created_at": "2022-09-04T14:37:34.295109Z",
"updated_at": "2022-09-04T14:37:34.295135Z",
"structure_string": "Sc2 Cd1 In1\n1.0\n-0.000000 3.528912 3.528912\n3.528912 -0.000000 3.528912\n3.528912 3.528912 0.000000\nSc Cd In\n2 1 1\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500001 0.500001 0.500001 Sc\n0.250000 0.250000 0.250000 Cd\n0.750000 0.750000 0.750000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sc",
"Cd",
"In"
],
"chemical_system": "Cd-In-Sc",
"density": 5.991682146933876,
"density_atomic": 0.04551007068138819,
"volume": 87.8926343139221,
"volume_molar": 13.232545390141123,
"formula_full": "Sc2 Cd1 In1",
"formula_reduced": "Sc2CdIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.602972555,
"spacegroup": 225
},
{
"id": "jvasp-20394",
"created_at": "2022-09-04T14:37:34.426627Z",
"updated_at": "2022-09-04T14:37:34.426652Z",
"structure_string": "U1 As1\n1.0\n3.540352 0.000000 2.044023\n1.180117 3.337876 2.044023\n0.000000 0.000000 4.088046\nU As\n1 1\ndirect\n0.500000 0.500001 0.500000 U\n0.000000 0.000000 0.000000 As\n",
"nsites": 2,
"nelements": 2,
"elements": [
"U",
"As"
],
"chemical_system": "As-U",
"density": 10.757029119980146,
"density_atomic": 0.04139973668189648,
"volume": 48.3094860087497,
"volume_molar": 14.546326239397064,
"formula_full": "U1 As1",
"formula_reduced": "UAs",
"formula_anonymous": "AB",
"energy_above_hull": 2.3922688750000005,
"spacegroup": 225
}
]
}