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=volume&page=152",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=volume&page=150",
"results": [
{
"id": "jvasp-114731",
"created_at": "2022-09-04T14:38:41.076687Z",
"updated_at": "2022-09-04T14:38:41.076715Z",
"structure_string": "Ca1 O2\n1.0\n3.800571 -1.074178 0.243078\n0.908757 -3.350469 -0.529509\n-1.499544 0.827684 -3.236982\nCa O\n1 2\ndirect\n0.053383 -0.177252 0.077813 Ca\n0.251211 0.143515 0.754428 O\n-0.144439 0.502037 0.401217 O\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ca",
"O"
],
"chemical_system": "Ca-O",
"density": 3.163525411419553,
"density_atomic": 0.07929539879124411,
"volume": 37.83321662708207,
"volume_molar": 7.594565197728688,
"formula_full": "Ca1 O2",
"formula_reduced": "CaO2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2165145000000004,
"spacegroup": 2
},
{
"id": "jvasp-114992",
"created_at": "2022-09-04T14:38:42.800855Z",
"updated_at": "2022-09-04T14:38:42.800886Z",
"structure_string": "Ge1 F1\n1.0\n3.910607 -0.000000 -0.000000\n-1.955303 3.386685 0.000000\n-0.000000 0.000000 2.858424\nGe F\n1 1\ndirect\n0.000000 0.000000 0.000000 Ge\n0.333335 0.666668 0.000000 F\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ge",
"F"
],
"chemical_system": "F-Ge",
"density": 4.019582837700724,
"density_atomic": 0.05283045711883212,
"volume": 37.856950499242856,
"volume_molar": 11.398994232539637,
"formula_full": "Ge1 F1",
"formula_reduced": "GeF",
"formula_anonymous": "AB",
"energy_above_hull": 0.0982664875,
"spacegroup": 187
},
{
"id": "jvasp-74176",
"created_at": "2022-09-04T14:36:11.430790Z",
"updated_at": "2022-09-04T14:36:11.430820Z",
"structure_string": "Be1 Cu1 Mo1\n1.0\n1.318341 -2.283435 0.000000\n1.318341 2.283435 -0.000000\n-0.000000 0.000000 6.288814\nBe Cu Mo\n1 1 1\ndirect\n0.000000 0.000000 0.014331 Be\n0.333333 0.666666 0.307300 Cu\n0.666666 0.333333 0.678368 Mo\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cu",
"Mo"
],
"chemical_system": "Be-Cu-Mo",
"density": 7.389740007150004,
"density_atomic": 0.07923299941284771,
"volume": 37.86301190452657,
"volume_molar": 7.600546242887156,
"formula_full": "Be1 Cu1 Mo1",
"formula_reduced": "BeCuMo",
"formula_anonymous": "ABC",
"energy_above_hull": 2.2798674833333337,
"spacegroup": 156
},
{
"id": "jvasp-123453",
"created_at": "2022-09-04T14:38:54.560841Z",
"updated_at": "2022-09-04T14:38:54.560867Z",
"structure_string": "Zr1 W1\n1.0\n1.435508 -2.486372 -0.000000\n1.435508 2.486372 -0.000000\n0.000000 -0.000000 5.305484\nZr W\n1 1\ndirect\n0.333334 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 W\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"W"
],
"chemical_system": "W-Zr",
"density": 12.060244803380215,
"density_atomic": 0.052808431369508926,
"volume": 37.87274016919163,
"volume_molar": 11.40374861328891,
"formula_full": "Zr1 W1",
"formula_reduced": "ZrW",
"formula_anonymous": "AB",
"energy_above_hull": 4.4070272500000005,
"spacegroup": 187
},
{
"id": "jvasp-67079",
"created_at": "2022-09-04T14:36:13.301023Z",
"updated_at": "2022-09-04T14:36:13.301041Z",
"structure_string": "Be1 Cr1 Ge1\n1.0\n1.348388 -2.335476 0.000000\n1.348388 2.335476 -0.000000\n0.000000 -0.000000 6.013217\nBe Cr Ge\n1 1 1\ndirect\n0.000000 0.000000 0.014858 Be\n0.333334 0.666668 0.318584 Cr\n0.666668 0.333334 0.666559 Ge\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Cr",
"Ge"
],
"chemical_system": "Be-Cr-Ge",
"density": 5.8598340643340245,
"density_atomic": 0.07921256835428105,
"volume": 37.87277779685659,
"volume_molar": 7.602506628829102,
"formula_full": "Be1 Cr1 Ge1",
"formula_reduced": "BeCrGe",
"formula_anonymous": "ABC",
"energy_above_hull": 2.3495264833333334,
"spacegroup": 156
},
{
"id": "jvasp-123439",
"created_at": "2022-09-04T14:38:51.006683Z",
"updated_at": "2022-09-04T14:38:51.006709Z",
"structure_string": "Zr1 Si1\n1.0\n1.592569 -2.758407 -0.000000\n1.592569 2.758407 -0.000000\n0.000000 0.000000 4.313621\nZr Si\n1 1\ndirect\n0.333334 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 Si\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Zr",
"Si"
],
"chemical_system": "Si-Zr",
"density": 5.22751802122141,
"density_atomic": 0.05277173965209997,
"volume": 37.89907274585012,
"volume_molar": 11.411677537449457,
"formula_full": "Zr1 Si1",
"formula_reduced": "ZrSi",
"formula_anonymous": "AB",
"energy_above_hull": 2.2962765500000004,
"spacegroup": 187
},
{
"id": "jvasp-79966",
"created_at": "2022-09-04T14:37:16.762076Z",
"updated_at": "2022-09-04T14:37:16.762105Z",
"structure_string": "Be3 Ru1\n1.0\n-1.589539 1.589539 3.750000\n1.589539 -1.589539 3.750000\n1.589539 1.589539 -3.750000\nBe Ru\n3 1\ndirect\n0.750001 0.250000 0.500001 Be\n0.250000 0.750001 0.500001 Be\n0.500001 0.500001 0.000000 Be\n0.000000 0.000000 0.000000 Ru\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Be",
"Ru"
],
"chemical_system": "Be-Ru",
"density": 5.612893273381543,
"density_atomic": 0.10554225191534534,
"volume": 37.89951348781501,
"volume_molar": 5.705905123978513,
"formula_full": "Be3 Ru1",
"formula_reduced": "Be3Ru",
"formula_anonymous": "AB3",
"energy_above_hull": 2.4194147000000004,
"spacegroup": 139
},
{
"id": "jvasp-17235",
"created_at": "2022-09-04T14:38:16.766521Z",
"updated_at": "2022-09-04T14:38:16.766532Z",
"structure_string": "Be1 Pd2\n1.0\n2.678518 0.000000 -0.715847\n-0.191314 2.671676 -0.715847\n-0.016809 -0.018055 5.306197\nBe Pd\n1 2\ndirect\n0.000000 0.000000 0.000000 Be\n0.356608 0.356606 0.713214 Pd\n0.643394 0.643393 0.286786 Pd\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Be",
"Pd"
],
"chemical_system": "Be-Pd",
"density": 9.719495004978516,
"density_atomic": 0.07915022497681586,
"volume": 37.902608626554624,
"volume_molar": 7.608494810676739,
"formula_full": "Be1 Pd2",
"formula_reduced": "BePd2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.3644625,
"spacegroup": 139
},
{
"id": "jvasp-18544",
"created_at": "2022-09-04T14:35:43.491887Z",
"updated_at": "2022-09-04T14:35:43.491913Z",
"structure_string": "Li1 Ni1 N1\n1.0\n1.785380 -3.092368 0.000000\n1.785380 3.092368 0.000000\n-0.000000 0.000000 3.433062\nLi Ni N\n1 1 1\ndirect\n0.000000 0.000000 0.500000 Li\n0.666667 0.333333 0.000000 Ni\n0.666667 0.333333 0.500000 N\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Li",
"Ni",
"N"
],
"chemical_system": "Li-N-Ni",
"density": 3.4886135956356386,
"density_atomic": 0.07913849307993401,
"volume": 37.90822750402694,
"volume_molar": 7.609622733045123,
"formula_full": "Li1 Ni1 N1",
"formula_reduced": "LiNiN",
"formula_anonymous": "ABC",
"energy_above_hull": 1.9782752166666664,
"spacegroup": 187
},
{
"id": "jvasp-18410",
"created_at": "2022-09-04T14:36:19.985836Z",
"updated_at": "2022-09-04T14:36:19.985856Z",
"structure_string": "Pu1 H2\n1.0\n3.266277 -0.000000 1.885786\n1.088759 3.079476 1.885786\n-0.000000 -0.000000 3.771571\nPu H\n1 2\ndirect\n0.000000 0.000000 0.000000 Pu\n0.750001 0.750001 0.750000 H\n0.250000 0.250000 0.250000 H\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Pu",
"H"
],
"chemical_system": "H-Pu",
"density": 10.768621546939482,
"density_atomic": 0.07908044972858988,
"volume": 37.93605132869411,
"volume_molar": 7.6152080326660325,
"formula_full": "Pu1 H2",
"formula_reduced": "PuH2",
"formula_anonymous": "AB2",
"energy_above_hull": 3.741886666666667,
"spacegroup": 225
},
{
"id": "jvasp-18402",
"created_at": "2022-09-04T14:35:59.818270Z",
"updated_at": "2022-09-04T14:35:59.818290Z",
"structure_string": "Mo2 H2\n1.0\n1.463076 -2.534122 -0.000000\n1.463076 2.534122 0.000000\n0.000000 -0.000000 5.116431\nMo H\n2 2\ndirect\n0.000000 0.000000 0.500000 Mo\n0.000000 0.000000 0.000000 Mo\n0.666668 0.333334 0.750000 H\n0.333334 0.666668 0.250000 H\n",
"nsites": 4,
"nelements": 2,
"elements": [
"Mo",
"H"
],
"chemical_system": "H-Mo",
"density": 8.486451932322034,
"density_atomic": 0.10543103465030537,
"volume": 37.93949298958544,
"volume_molar": 5.7119241786579185,
"formula_full": "Mo2 H2",
"formula_reduced": "MoH",
"formula_anonymous": "AB",
"energy_above_hull": 3.094882950000001,
"spacegroup": 194
},
{
"id": "jvasp-70172",
"created_at": "2022-09-04T14:36:16.983426Z",
"updated_at": "2022-09-04T14:36:16.983448Z",
"structure_string": "Be1 Tc1 Rh1\n1.0\n1.347947 -2.334714 -0.000000\n1.347947 2.334714 0.000000\n-0.000000 0.000000 6.030215\nBe Tc Rh\n1 1 1\ndirect\n0.000000 0.000000 0.008390 Be\n0.333334 0.666668 0.678193 Tc\n0.666668 0.333334 0.313417 Rh\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Be",
"Tc",
"Rh"
],
"chemical_system": "Be-Rh-Tc",
"density": 9.183935462176896,
"density_atomic": 0.07904091486170921,
"volume": 37.9550262702403,
"volume_molar": 7.619017024962831,
"formula_full": "Be1 Tc1 Rh1",
"formula_reduced": "BeTcRh",
"formula_anonymous": "ABC",
"energy_above_hull": 3.0071835333333325,
"spacegroup": 156
}
]
}