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=nsites&page=869",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=nsites&page=867",
"results": [
{
"id": "jvasp-123467",
"created_at": "2022-09-04T14:38:53.572070Z",
"updated_at": "2022-09-04T14:38:53.572087Z",
"structure_string": "U3 Bi1\n1.0\n3.125488 0.000000 0.000000\n0.000000 5.621917 0.000000\n0.000000 0.000000 5.342486\nU Bi\n3 1\ndirect\n0.500000 0.333475 0.250000 U\n0.500000 0.671817 0.750001 U\n0.000000 0.824662 0.250000 U\n0.000000 0.170047 0.750001 Bi\n",
"nsites": 4,
"nelements": 2,
"elements": [
"U",
"Bi"
],
"chemical_system": "Bi-U",
"density": 16.3281403804465,
"density_atomic": 0.04261027461960199,
"volume": 93.87407229147219,
"volume_molar": 14.133071926341533,
"formula_full": "U3 Bi1",
"formula_reduced": "U3Bi",
"formula_anonymous": "AB3",
"energy_above_hull": 4.756753075,
"spacegroup": 25
},
{
"id": "jvasp-118066",
"created_at": "2022-09-04T14:38:53.595768Z",
"updated_at": "2022-09-04T14:38:53.595797Z",
"structure_string": "Sr2 H1 Cl1\n1.0\n-0.000000 3.714744 3.714744\n3.714744 0.000000 3.714744\n3.714744 3.714744 0.000000\nSr H Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sr\n0.749999 0.749999 0.749999 Sr\n0.500000 0.500000 0.500000 H\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Sr",
"H",
"Cl"
],
"chemical_system": "Cl-H-Sr",
"density": 3.428903149238146,
"density_atomic": 0.039016052407240834,
"volume": 102.52190452916389,
"volume_molar": 15.435033501447663,
"formula_full": "Sr2 H1 Cl1",
"formula_reduced": "Sr2HCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.231934171875,
"spacegroup": 225
},
{
"id": "jvasp-123479",
"created_at": "2022-09-04T14:38:53.645247Z",
"updated_at": "2022-09-04T14:38:53.645273Z",
"structure_string": "Er1 U3\n1.0\n2.920255 0.000000 0.000000\n0.000000 5.878989 0.000000\n0.000000 0.000000 5.149495\nEr U\n1 3\ndirect\n0.000000 0.109887 0.750001 Er\n0.499999 0.405204 0.250000 U\n0.499999 0.607587 0.750001 U\n0.000000 0.877322 0.250000 U\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Er",
"U"
],
"chemical_system": "Er-U",
"density": 16.554167211426734,
"density_atomic": 0.045245138997264886,
"volume": 88.40728725005805,
"volume_molar": 13.310028200740073,
"formula_full": "Er1 U3",
"formula_reduced": "ErU3",
"formula_anonymous": "AB3",
"energy_above_hull": 4.881307,
"spacegroup": 25
},
{
"id": "jvasp-120970",
"created_at": "2022-09-04T14:38:53.664176Z",
"updated_at": "2022-09-04T14:38:53.664201Z",
"structure_string": "Rb1 Mo1 Cl2\n1.0\n3.508230 0.000000 0.000000\n0.000000 3.508230 0.000000\n0.000000 0.000000 7.605959\nRb Mo Cl\n1 1 2\ndirect\n0.500000 0.500000 0.593161 Rb\n0.000000 0.000000 0.001101 Mo\n0.000000 0.000000 0.339830 Cl\n0.500000 0.500000 0.075907 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Rb",
"Mo",
"Cl"
],
"chemical_system": "Cl-Mo-Rb",
"density": 4.475690076729525,
"density_atomic": 0.04272970507283369,
"volume": 93.61169222165037,
"volume_molar": 14.093569683514392,
"formula_full": "Rb1 Mo1 Cl2",
"formula_reduced": "RbMoCl2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.25918100875,
"spacegroup": 99
},
{
"id": "jvasp-120313",
"created_at": "2022-09-04T14:38:53.676815Z",
"updated_at": "2022-09-04T14:38:53.676849Z",
"structure_string": "Li3 Sb1\n1.0\n5.769744 -0.000000 0.000000\n-2.884872 4.996745 0.000000\n-0.000000 0.000000 3.016781\nLi Sb\n3 1\ndirect\n0.500014 0.000000 0.000000 Li\n0.999999 0.500014 0.000000 Li\n0.499985 0.499985 0.000000 Li\n0.000000 0.000000 0.000000 Sb\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Li",
"Sb"
],
"chemical_system": "Li-Sb",
"density": 2.722258300625125,
"density_atomic": 0.04599096014842794,
"volume": 86.97361366430893,
"volume_molar": 13.094183597308193,
"formula_full": "Li3 Sb1",
"formula_reduced": "Li3Sb",
"formula_anonymous": "AB3",
"energy_above_hull": 0.8592190250000002,
"spacegroup": 191
},
{
"id": "jvasp-120157",
"created_at": "2022-09-04T14:38:53.681147Z",
"updated_at": "2022-09-04T14:38:53.681172Z",
"structure_string": "Mn1 Tl1 F2\n1.0\n3.199167 0.000000 -0.000000\n0.000000 3.199167 0.000000\n0.000000 -0.000000 6.840843\nMn Tl F\n1 1 2\ndirect\n0.500001 0.500001 0.456857 Mn\n0.000000 0.000000 0.906594 Tl\n0.000000 0.000000 0.472009 F\n0.500001 0.500001 0.174540 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Mn",
"Tl",
"F"
],
"chemical_system": "F-Mn-Tl",
"density": 7.051590360056098,
"density_atomic": 0.05713162085103981,
"volume": 70.01376716458411,
"volume_molar": 10.540819025074791,
"formula_full": "Mn1 Tl1 F2",
"formula_reduced": "MnTlF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.4548301015948276,
"spacegroup": 99
},
{
"id": "jvasp-118493",
"created_at": "2022-09-04T14:38:53.724318Z",
"updated_at": "2022-09-04T14:38:53.724334Z",
"structure_string": "Si1 H1 O2\n1.0\n3.281430 0.000000 0.000000\n0.000000 3.281430 0.000000\n0.000000 -0.000000 3.454129\nSi H O\n1 1 2\ndirect\n0.500001 0.500001 0.537033 Si\n0.000000 0.000000 0.857542 H\n0.000000 0.000000 0.571809 O\n0.500001 0.500001 0.043617 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Si",
"H",
"O"
],
"chemical_system": "H-O-Si",
"density": 2.72753483046018,
"density_atomic": 0.10754621983093286,
"volume": 37.19331099027159,
"volume_molar": 5.599583852846763,
"formula_full": "Si1 H1 O2",
"formula_reduced": "SiHO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3385389,
"spacegroup": 99
},
{
"id": "jvasp-119977",
"created_at": "2022-09-04T14:38:53.733491Z",
"updated_at": "2022-09-04T14:38:53.733509Z",
"structure_string": "Ag1 As1 F2\n1.0\n3.783376 -0.000000 0.000000\n-0.000000 3.783376 -0.000000\n0.000000 -0.000000 4.307346\nAg As F\n1 1 2\ndirect\n0.500001 0.500001 0.737066 Ag\n0.000000 0.000000 0.806727 As\n0.000000 0.000000 0.224803 F\n0.500001 0.500001 0.241406 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ag",
"As",
"F"
],
"chemical_system": "Ag-As-F",
"density": 5.946385399461651,
"density_atomic": 0.0648770692842934,
"volume": 61.65506617556769,
"volume_molar": 9.282387176909587,
"formula_full": "Ag1 As1 F2",
"formula_reduced": "AgAsF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2435823350000002,
"spacegroup": 99
},
{
"id": "jvasp-119939",
"created_at": "2022-09-04T14:38:53.953680Z",
"updated_at": "2022-09-04T14:38:53.953696Z",
"structure_string": "Ba1 C1 O2\n1.0\n4.083503 0.000000 0.000000\n0.000000 4.083503 -0.000000\n0.000000 0.000000 4.773804\nBa C O\n1 1 2\ndirect\n0.500000 0.500000 0.452623 Ba\n0.000000 0.000000 -0.075882 C\n0.000000 0.000000 0.674692 O\n0.500000 0.500000 0.958565 O\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"C",
"O"
],
"chemical_system": "Ba-C-O",
"density": 3.7827181613853047,
"density_atomic": 0.050249257554089787,
"volume": 79.60316618995378,
"volume_molar": 11.984536793439364,
"formula_full": "Ba1 C1 O2",
"formula_reduced": "BaCO2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.3939382425,
"spacegroup": 99
},
{
"id": "jvasp-123343",
"created_at": "2022-09-04T14:38:54.002493Z",
"updated_at": "2022-09-04T14:38:54.002516Z",
"structure_string": "Ag3 Mo1\n1.0\n4.158752 -0.000000 0.000000\n-0.000000 4.158752 -0.000000\n0.000000 -0.000000 4.158752\nAg Mo\n3 1\ndirect\n0.000000 0.500000 0.500000 Ag\n0.500000 0.000000 0.500000 Ag\n0.500000 0.500000 0.000000 Ag\n0.000000 0.000000 0.000000 Mo\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Ag",
"Mo"
],
"chemical_system": "Ag-Mo",
"density": 9.68585949681745,
"density_atomic": 0.0556123084807431,
"volume": 71.92652326930614,
"volume_molar": 10.828791187629424,
"formula_full": "Ag3 Mo1",
"formula_reduced": "Ag3Mo",
"formula_anonymous": "AB3",
"energy_above_hull": 1.47282192,
"spacegroup": 221
},
{
"id": "jvasp-120368",
"created_at": "2022-09-04T14:38:54.071294Z",
"updated_at": "2022-09-04T14:38:54.071322Z",
"structure_string": "As2 C2\n1.0\n7.627025 -0.954384 -2.963831\n3.273324 -2.702954 0.294060\n3.401168 3.521728 -8.709881\nAs C\n2 2\ndirect\n-0.279494 -0.033743 0.238606 As\n0.723135 0.866611 0.735767 As\n0.720878 -0.106225 0.547993 C\n0.722764 -0.060907 0.426382 C\n",
"nsites": 4,
"nelements": 2,
"elements": [
"As",
"C"
],
"chemical_system": "As-C",
"density": 3.517310338152766,
"density_atomic": 0.04873157148787991,
"volume": 82.0823108689373,
"volume_molar": 12.357780748970459,
"formula_full": "As2 C2",
"formula_reduced": "AsC",
"formula_anonymous": "AB",
"energy_above_hull": 3.161840875,
"spacegroup": 12
},
{
"id": "jvasp-122647",
"created_at": "2022-09-04T14:38:54.074329Z",
"updated_at": "2022-09-04T14:38:54.074365Z",
"structure_string": "Be1 Ga3\n1.0\n4.285644 -0.222985 0.017238\n-2.269553 3.642196 -0.017238\n0.017386 -0.010251 4.483189\nBe Ga\n1 3\ndirect\n0.188066 0.811938 0.918244 Be\n0.313420 0.686582 0.410714 Ga\n0.885181 0.114821 0.028566 Ga\n0.613338 0.386665 0.642477 Ga\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Be",
"Ga"
],
"chemical_system": "Be-Ga",
"density": 5.350849042432595,
"density_atomic": 0.059076710163163536,
"volume": 67.70857735565215,
"volume_molar": 10.193764587377146,
"formula_full": "Be1 Ga3",
"formula_reduced": "BeGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.1513257687499999,
"spacegroup": 8
}
]
}