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=3457",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=formula_anonymous&page=3455",
"results": [
{
"id": "jvasp-36812",
"created_at": "2022-09-04T14:38:29.842953Z",
"updated_at": "2022-09-04T14:38:29.842970Z",
"structure_string": "Ca1 Ag1 O2\n1.0\n3.355885 0.000000 0.000000\n-0.000000 3.355885 0.000000\n-0.000000 -0.000000 4.675380\nCa Ag O\n1 1 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.499999 0.499999 0.000000 Ag\n0.000000 0.000000 0.000000 O\n0.499999 0.499999 0.500000 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ca",
"Ag",
"O"
],
"chemical_system": "Ag-Ca-O",
"density": 5.674894950576131,
"density_atomic": 0.0759676928003398,
"volume": 52.65396186919749,
"volume_molar": 7.927239248699499,
"formula_full": "Ca1 Ag1 O2",
"formula_reduced": "CaAgO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.5861761699999999,
"spacegroup": 123
},
{
"id": "jvasp-16645",
"created_at": "2022-09-04T14:38:29.836626Z",
"updated_at": "2022-09-04T14:38:29.836655Z",
"structure_string": "Er1 Ni1 C2\n1.0\n3.517756 0.000000 0.000000\n0.000000 3.600736 -1.062392\n0.000000 0.006548 3.754189\nEr Ni C\n1 1 2\ndirect\n0.000000 0.001446 0.998555 Er\n0.500000 0.614133 0.385869 Ni\n0.500000 0.454444 0.849020 C\n0.500000 0.150981 0.545557 C\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Er",
"Ni",
"C"
],
"chemical_system": "C-Er-Ni",
"density": 8.724630132581234,
"density_atomic": 0.08407433219881233,
"volume": 47.57694643998023,
"volume_molar": 7.162876709813546,
"formula_full": "Er1 Ni1 C2",
"formula_reduced": "ErNiC2",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.5046881,
"spacegroup": 38
},
{
"id": "jvasp-109589",
"created_at": "2022-09-04T14:38:28.183689Z",
"updated_at": "2022-09-04T14:38:28.183712Z",
"structure_string": "Pr2 Mg1 In1\n1.0\n4.755998 0.000000 2.745877\n1.585333 4.483998 2.745877\n-0.000000 -0.000000 5.491753\nPr Mg In\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Pr\n0.750000 0.750000 0.750000 Pr\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500000 0.500000 In\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pr",
"Mg",
"In"
],
"chemical_system": "In-Mg-Pr",
"density": 5.968283862236194,
"density_atomic": 0.03415402734932274,
"volume": 117.11649578213851,
"volume_molar": 17.63230057294961,
"formula_full": "Pr2 Mg1 In1",
"formula_reduced": "Pr2MgIn",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4575374625,
"spacegroup": 225
},
{
"id": "jvasp-115925",
"created_at": "2022-09-04T14:38:29.829510Z",
"updated_at": "2022-09-04T14:38:29.829543Z",
"structure_string": "Pd1 S1 Cl2\n1.0\n3.823987 -0.000000 -0.000000\n-0.000000 3.823987 0.000000\n-0.000000 0.000000 5.269068\nPd S Cl\n1 1 2\ndirect\n0.500000 0.500000 0.502467 Pd\n0.000000 0.000000 0.002496 S\n0.000000 0.000000 0.502531 Cl\n0.500000 0.500000 0.002506 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Pd",
"S",
"Cl"
],
"chemical_system": "Cl-Pd-S",
"density": 4.512741851467111,
"density_atomic": 0.05191506158807117,
"volume": 77.04893103544163,
"volume_molar": 11.599987702574051,
"formula_full": "Pd1 S1 Cl2",
"formula_reduced": "PdSCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.02859845875,
"spacegroup": 123
},
{
"id": "jvasp-38146",
"created_at": "2022-09-04T14:38:29.065446Z",
"updated_at": "2022-09-04T14:38:29.065481Z",
"structure_string": "Nd1 Sm1 Zn2\n1.0\n-0.000000 3.645684 3.645684\n3.645684 0.000000 3.645684\n3.645684 3.645684 0.000000\nNd Sm Zn\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Nd\n0.749999 0.749999 0.749999 Sm\n0.000000 0.000000 0.000000 Zn\n0.499998 0.499998 0.499998 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Nd",
"Sm",
"Zn"
],
"chemical_system": "Nd-Sm-Zn",
"density": 7.289536893349538,
"density_atomic": 0.04127555569755485,
"volume": 96.90965832925076,
"volume_molar": 14.590090086556364,
"formula_full": "Nd1 Sm1 Zn2",
"formula_reduced": "NdSmZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 225
},
{
"id": "jvasp-59686",
"created_at": "2022-09-04T14:38:29.292709Z",
"updated_at": "2022-09-04T14:38:29.292734Z",
"structure_string": "Nb4 Co4 B8\n1.0\n3.152031 0.000000 0.000000\n-0.000000 5.994068 0.000000\n0.000000 0.000000 8.235706\nNb Co B\n4 4 8\ndirect\n0.250000 0.635149 0.632159 Nb\n0.750000 0.364852 0.367842 Nb\n0.250000 0.135148 0.867842 Nb\n0.750000 0.864852 0.132158 Nb\n0.750000 0.006546 0.613633 Co\n0.750000 0.506546 0.886368 Co\n0.250000 0.993454 0.386368 Co\n0.250000 0.493454 0.113633 Co\n0.250000 0.667171 0.330007 B\n0.750000 0.332829 0.669994 B\n0.250000 0.167171 0.169994 B\n0.750000 0.832829 0.830007 B\n0.250000 0.732883 0.922452 B\n0.750000 0.767117 0.422452 B\n0.250000 0.232883 0.577549 B\n0.750000 0.267117 0.077548 B\n",
"nsites": 16,
"nelements": 3,
"elements": [
"Nb",
"Co",
"B"
],
"chemical_system": "B-Co-Nb",
"density": 7.404562340537136,
"density_atomic": 0.1028269614093369,
"volume": 155.60121373524478,
"volume_molar": 5.856577572128059,
"formula_full": "Nb4 Co4 B8",
"formula_reduced": "NbCoB2",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.281838866666667,
"spacegroup": 62
},
{
"id": "jvasp-109273",
"created_at": "2022-09-04T14:38:18.910362Z",
"updated_at": "2022-09-04T14:38:18.910380Z",
"structure_string": "Dy2 Mg1 Cd1\n1.0\n4.567399 0.000000 2.636989\n1.522466 4.306185 2.636989\n-0.000000 -0.000000 5.273978\nDy Mg Cd\n2 1 1\ndirect\n0.750000 0.750001 0.750000 Dy\n0.250000 0.250000 0.250000 Dy\n0.000000 0.000000 0.000000 Mg\n0.500000 0.500001 0.500000 Cd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Dy",
"Mg",
"Cd"
],
"chemical_system": "Cd-Dy-Mg",
"density": 7.391355176394223,
"density_atomic": 0.038562043589377856,
"volume": 103.72894244385492,
"volume_molar": 15.616757307070817,
"formula_full": "Dy2 Mg1 Cd1",
"formula_reduced": "Dy2MgCd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.41104606875,
"spacegroup": 225
},
{
"id": "jvasp-55133",
"created_at": "2022-09-04T14:38:29.284054Z",
"updated_at": "2022-09-04T14:38:29.284075Z",
"structure_string": "Na1 Ni1 O2\n1.0\n2.865794 -0.001126 4.642968\n1.316664 2.545421 4.642968\n-0.001852 -0.001126 5.456182\nNa Ni O\n1 1 2\ndirect\n0.500000 0.499998 0.500002 Na\n0.000000 0.000000 0.000000 Ni\n0.269104 0.269103 0.269105 O\n0.730895 0.730893 0.730898 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Na",
"Ni",
"O"
],
"chemical_system": "Na-Ni-O",
"density": 4.7384016592836105,
"density_atomic": 0.10040403754513377,
"volume": 39.83903533960887,
"volume_molar": 5.997906963943476,
"formula_full": "Na1 Ni1 O2",
"formula_reduced": "NaNiO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9612121,
"spacegroup": 166
},
{
"id": "jvasp-109259",
"created_at": "2022-09-04T14:38:17.858128Z",
"updated_at": "2022-09-04T14:38:17.858158Z",
"structure_string": "U4 As2 Se2\n1.0\n5.283723 0.015486 -4.714347\n-1.050104 5.178344 -4.714347\n-0.012623 -0.015486 7.081147\nU As Se\n4 2 2\ndirect\n0.748907 0.748907 -0.000001 U\n0.251093 0.251093 -0.000000 U\n0.001094 0.501093 0.500000 U\n0.498907 0.998906 0.499999 U\n0.500000 0.500000 -0.000000 As\n0.250001 0.749999 0.500000 As\n0.000000 0.000000 0.000000 Se\n0.750000 0.250000 0.500000 Se\n",
"nsites": 8,
"nelements": 3,
"elements": [
"U",
"As",
"Se"
],
"chemical_system": "As-Se-U",
"density": 10.834600441824879,
"density_atomic": 0.04143096106706626,
"volume": 193.092310531972,
"volume_molar": 14.535363421214573,
"formula_full": "U4 As2 Se2",
"formula_reduced": "U2AsSe",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.674906779166667,
"spacegroup": 141
},
{
"id": "jvasp-17685",
"created_at": "2022-09-04T14:38:20.132997Z",
"updated_at": "2022-09-04T14:38:20.133016Z",
"structure_string": "Li1 Ga2 Pt1\n1.0\n3.781338 -0.000000 2.183156\n1.260446 3.565079 2.183156\n-0.000000 -0.000000 4.366313\nLi Ga Pt\n1 2 1\ndirect\n0.500001 0.500000 0.500000 Li\n0.250000 0.250000 0.250000 Ga\n0.750001 0.750000 0.750000 Ga\n0.000000 0.000000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Li",
"Ga",
"Pt"
],
"chemical_system": "Ga-Li-Pt",
"density": 9.633262657632054,
"density_atomic": 0.06795641647151286,
"volume": 58.86125560603668,
"volume_molar": 8.8617691642473,
"formula_full": "Li1 Ga2 Pt1",
"formula_reduced": "LiGa2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4587790125000001,
"spacegroup": 225
},
{
"id": "jvasp-109971",
"created_at": "2022-09-04T14:38:17.886071Z",
"updated_at": "2022-09-04T14:38:17.886090Z",
"structure_string": "Ho1 Sc1 Zn2\n1.0\n4.207436 -0.000000 2.429164\n1.402479 3.966808 2.429164\n-0.000000 -0.000000 4.858328\nHo Sc Zn\n1 1 2\ndirect\n0.500001 0.500000 0.499999 Ho\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.249999 Zn\n0.750001 0.750000 0.749998 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ho",
"Sc",
"Zn"
],
"chemical_system": "Ho-Sc-Zn",
"density": 6.977198755143816,
"density_atomic": 0.0493303799390355,
"volume": 81.08593537984835,
"volume_molar": 12.20777291284277,
"formula_full": "Ho1 Sc1 Zn2",
"formula_reduced": "HoScZn2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.1131379041666664,
"spacegroup": 225
},
{
"id": "jvasp-108821",
"created_at": "2022-09-04T14:38:20.098380Z",
"updated_at": "2022-09-04T14:38:20.098402Z",
"structure_string": "Li2 V2 O4\n1.0\n4.080085 0.171123 -0.000156\n-1.857919 4.022820 -1.971674\n0.000147 0.000402 3.942557\nLi V O\n2 2 4\ndirect\n0.399117 0.265687 0.877825 Li\n0.599634 0.736091 0.613004 Li\n0.099497 0.774282 0.132097 V\n0.899259 0.227453 0.358697 V\n0.889860 0.256300 0.873124 O\n0.108892 0.745445 0.617677 O\n0.392090 0.243948 0.366948 O\n0.606669 0.757797 0.123855 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Li",
"V",
"O"
],
"chemical_system": "Li-O-V",
"density": 4.524991036060303,
"density_atomic": 0.12127164589880407,
"volume": 65.96760471673365,
"volume_molar": 4.9658275150526245,
"formula_full": "Li2 V2 O4",
"formula_reduced": "LiVO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.8532153,
"spacegroup": 12
}
]
}