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=-density_atomic&page=3653",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-density_atomic&page=3651",
"results": [
{
"id": "jvasp-94798",
"created_at": "2022-09-04T14:35:51.358041Z",
"updated_at": "2022-09-04T14:35:51.358072Z",
"structure_string": "Na1 Cl7\n1.0\n5.871739 0.000000 0.000000\n-0.000000 5.871739 -0.000000\n-0.000000 -0.000000 5.871739\nNa Cl\n1 7\ndirect\n0.000000 0.000000 0.000000 Na\n0.500000 0.500000 0.500000 Cl\n0.000000 0.177290 0.500000 Cl\n0.000000 0.822711 0.500000 Cl\n0.500000 0.000000 0.177290 Cl\n0.500000 0.000000 0.822711 Cl\n0.177290 0.500000 0.000000 Cl\n0.822711 0.500000 0.000000 Cl\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Na",
"Cl"
],
"chemical_system": "Cl-Na",
"density": 2.224209678480892,
"density_atomic": 0.039517526974896564,
"volume": 202.44181790732972,
"volume_molar": 15.239164039352854,
"formula_full": "Na1 Cl7",
"formula_reduced": "NaCl7",
"formula_anonymous": "AB7",
"energy_above_hull": 0.263113050625,
"spacegroup": 200
},
{
"id": "jvasp-42081",
"created_at": "2022-09-04T14:37:33.763776Z",
"updated_at": "2022-09-04T14:37:33.763795Z",
"structure_string": "Ac2 Ni1 Ir1\n1.0\n-0.000000 3.698985 3.698985\n3.698985 -0.000000 3.698985\n3.698985 3.698985 0.000000\nAc Ni Ir\n2 1 1\ndirect\n0.500000 0.500000 0.500000 Ac\n0.000000 0.000000 0.000000 Ac\n0.750002 0.750002 0.750002 Ni\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ac",
"Ni",
"Ir"
],
"chemical_system": "Ac-Ir-Ni",
"density": 11.563926144603876,
"density_atomic": 0.03951684696671499,
"volume": 101.22265076890363,
"volume_molar": 15.2394262757665,
"formula_full": "Ac2 Ni1 Ir1",
"formula_reduced": "Ac2NiIr",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.6734933749999996,
"spacegroup": 225
},
{
"id": "jvasp-36210",
"created_at": "2022-09-04T14:37:29.613066Z",
"updated_at": "2022-09-04T14:37:29.613099Z",
"structure_string": "Y1 Bi1 Pd1\n1.0\n3.360803 3.360803 -0.000000\n3.360803 0.000000 -3.360803\n0.000000 3.360803 -3.360803\nY Bi Pd\n1 1 1\ndirect\n0.500000 0.500000 0.500000 Y\n0.000000 0.000000 0.000000 Bi\n0.749999 0.749999 0.749999 Pd\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Y",
"Bi",
"Pd"
],
"chemical_system": "Bi-Pd-Y",
"density": 8.843015538999703,
"density_atomic": 0.03951500947892362,
"volume": 75.92051829318501,
"volume_molar": 15.24013492445717,
"formula_full": "Y1 Bi1 Pd1",
"formula_reduced": "YBiPd",
"formula_anonymous": "ABC",
"energy_above_hull": 1.2965684833333335,
"spacegroup": 216
},
{
"id": "jvasp-93719",
"created_at": "2022-09-04T14:35:59.130532Z",
"updated_at": "2022-09-04T14:35:59.130558Z",
"structure_string": "Ce4 Mg2\n1.0\n3.117768 -0.000000 0.000000\n-1.558883 2.700066 0.000000\n0.000000 -0.000000 18.037402\nCe Mg\n4 2\ndirect\n0.333334 0.666668 0.913750 Ce\n0.333334 0.666668 0.586249 Ce\n0.666668 0.333333 0.413750 Ce\n0.666668 0.333333 0.086249 Ce\n0.666668 0.333333 0.750000 Mg\n0.333334 0.666668 0.250000 Mg\n",
"nsites": 6,
"nelements": 2,
"elements": [
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg",
"density": 6.6608092771586245,
"density_atomic": 0.03951473652438789,
"volume": 151.84208545328127,
"volume_molar": 15.240240198193469,
"formula_full": "Ce4 Mg2",
"formula_reduced": "Ce2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2674819761904763,
"spacegroup": 194
},
{
"id": "jvasp-117594",
"created_at": "2022-09-04T14:38:46.336904Z",
"updated_at": "2022-09-04T14:38:46.336926Z",
"structure_string": "Ba1 Pb1 F2\n1.0\n3.735873 0.000000 0.000000\n-0.000000 3.735873 -0.000000\n-0.000000 0.000000 7.253023\nBa Pb F\n1 1 2\ndirect\n0.500000 0.500000 0.475954 Ba\n0.000000 0.000000 0.921285 Pb\n0.000000 0.000000 0.465485 F\n0.500000 0.500000 0.147275 F\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Pb",
"F"
],
"chemical_system": "Ba-F-Pb",
"density": 6.274863795893023,
"density_atomic": 0.03951452161619445,
"volume": 101.2286075193343,
"volume_molar": 15.24032308550564,
"formula_full": "Ba1 Pb1 F2",
"formula_reduced": "BaPbF2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-21469",
"created_at": "2022-09-04T14:37:52.569368Z",
"updated_at": "2022-09-04T14:37:52.569388Z",
"structure_string": "Te8 Rh3\n1.0\n6.529676 -0.008151 -0.090561\n-0.091712 6.529037 -0.090562\n-0.008047 -0.008150 6.530299\nTe Rh\n8 3\ndirect\n0.368828 0.368828 0.368828 Te\n0.631173 0.631173 0.631173 Te\n0.129778 0.627375 0.876614 Te\n0.876614 0.129778 0.627375 Te\n0.627375 0.876614 0.129779 Te\n0.870223 0.372626 0.123387 Te\n0.123387 0.870222 0.372626 Te\n0.372625 0.123387 0.870222 Te\n0.500001 0.500000 0.000000 Rh\n-0.000000 0.500000 0.500000 Rh\n0.500000 0.000000 0.500000 Rh\n",
"nsites": 11,
"nelements": 2,
"elements": [
"Te",
"Rh"
],
"chemical_system": "Rh-Te",
"density": 7.93033751542147,
"density_atomic": 0.03951313856544755,
"volume": 278.388414572033,
"volume_molar": 15.240856531872891,
"formula_full": "Te8 Rh3",
"formula_reduced": "Te8Rh3",
"formula_anonymous": "A3B8",
"energy_above_hull": 1.727958284848485,
"spacegroup": 148
},
{
"id": "jvasp-20617",
"created_at": "2022-09-04T14:38:09.252344Z",
"updated_at": "2022-09-04T14:38:09.252372Z",
"structure_string": "Lu1 Mg1\n1.0\n3.699120 -0.000000 -0.000000\n-0.000000 3.699120 -0.000000\n0.000000 -0.000000 3.699120\nLu Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Lu",
"Mg"
],
"chemical_system": "Lu-Mg",
"density": 6.537325609488343,
"density_atomic": 0.0395125206028911,
"volume": 50.61686699515853,
"volume_molar": 15.241094893752146,
"formula_full": "Lu1 Mg1",
"formula_reduced": "LuMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.3541235833333332,
"spacegroup": 221
},
{
"id": "jvasp-20427",
"created_at": "2022-09-04T14:37:36.287259Z",
"updated_at": "2022-09-04T14:37:36.287282Z",
"structure_string": "Lu1 Mg1\n1.0\n3.699120 -0.000000 -0.000000\n-0.000000 3.699120 -0.000000\n0.000000 -0.000000 3.699120\nLu Mg\n1 1\ndirect\n0.500000 0.500000 0.500000 Lu\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Lu",
"Mg"
],
"chemical_system": "Lu-Mg",
"density": 6.537325609488343,
"density_atomic": 0.0395125206028911,
"volume": 50.61686699515853,
"volume_molar": 15.241094893752146,
"formula_full": "Lu1 Mg1",
"formula_reduced": "LuMg",
"formula_anonymous": "AB",
"energy_above_hull": 0.3541235833333332,
"spacegroup": 221
},
{
"id": "jvasp-54943",
"created_at": "2022-09-04T14:38:32.486440Z",
"updated_at": "2022-09-04T14:38:32.486456Z",
"structure_string": "Pr6 Cu2 Ge2 Se14\n1.0\n5.338457 -9.246478 0.000000\n5.338457 9.246478 0.000000\n0.000000 0.000000 6.152957\nPr Cu Ge Se\n6 2 2 14\ndirect\n0.774889 0.130909 0.748438 Pr\n0.356020 0.225111 0.748438 Pr\n0.869091 0.643980 0.748438 Pr\n0.130909 0.356020 0.248437 Pr\n0.643980 0.774889 0.248437 Pr\n0.225111 0.869091 0.248437 Pr\n0.000000 0.000000 0.219830 Cu\n0.000000 0.000000 0.719830 Cu\n0.333333 0.666667 0.830957 Ge\n0.666667 0.333333 0.330957 Ge\n0.743002 0.837978 0.730801 Se\n0.481261 0.902495 0.989027 Se\n0.905025 0.743002 0.230801 Se\n0.902495 0.421235 0.489027 Se\n0.518740 0.097506 0.489027 Se\n0.097506 0.578765 0.989027 Se\n0.094976 0.256998 0.730801 Se\n0.162023 0.905025 0.730801 Se\n0.666667 0.333333 0.948219 Se\n0.421235 0.518740 0.989027 Se\n0.837978 0.094976 0.230801 Se\n0.256998 0.162023 0.230801 Se\n0.333333 0.666667 0.448218 Se\n0.578765 0.481261 0.489027 Se\n",
"nsites": 24,
"nelements": 4,
"elements": [
"Pr",
"Cu",
"Ge",
"Se"
],
"chemical_system": "Cu-Ge-Pr-Se",
"density": 6.077612076141979,
"density_atomic": 0.039509840494727416,
"volume": 607.4436064403449,
"volume_molar": 15.242128757274164,
"formula_full": "Pr6 Cu2 Ge2 Se14",
"formula_reduced": "Pr3CuGeSe7",
"formula_anonymous": "ABC3D7",
"energy_above_hull": 1.430034126388889,
"spacegroup": 173
},
{
"id": "jvasp-35180",
"created_at": "2022-09-04T14:37:55.906515Z",
"updated_at": "2022-09-04T14:37:55.906541Z",
"structure_string": "Sr4 S3 O1\n1.0\n5.872171 0.000000 -0.000000\n0.000000 5.872171 -0.000000\n0.000000 0.000000 5.872171\nSr S O\n4 3 1\ndirect\n0.000000 0.000000 0.500000 Sr\n0.500000 0.500000 0.500000 Sr\n0.500000 0.000000 0.000000 Sr\n0.000000 0.500000 0.000000 Sr\n0.500000 0.500000 0.000000 S\n0.500000 0.000000 0.500000 S\n0.000000 0.500000 0.500000 S\n0.000000 0.000000 0.000000 O\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Sr",
"S",
"O"
],
"chemical_system": "O-S-Sr",
"density": 3.79427222010888,
"density_atomic": 0.039508806018486824,
"volume": 202.48650380010642,
"volume_molar": 15.242527848556445,
"formula_full": "Sr4 S3 O1",
"formula_reduced": "Sr4S3O",
"formula_anonymous": "AB3C4",
"energy_above_hull": 0.5535748425,
"spacegroup": 221
},
{
"id": "jvasp-101554",
"created_at": "2022-09-04T14:37:00.265496Z",
"updated_at": "2022-09-04T14:37:00.265514Z",
"structure_string": "Ce2 Mg1\n1.0\n3.648970 0.691654 -7.162667\n0.398199 3.692533 -7.162667\n-0.638485 -0.691654 8.013184\nCe Mg\n2 1\ndirect\n0.668527 0.668526 -0.000002 Ce\n0.331473 0.331472 -0.000001 Ce\n0.000000 0.000000 0.000000 Mg\n",
"nsites": 3,
"nelements": 2,
"elements": [
"Ce",
"Mg"
],
"chemical_system": "Ce-Mg",
"density": 6.659687632871376,
"density_atomic": 0.039508082456294884,
"volume": 75.93382957319422,
"volume_molar": 15.242807004520877,
"formula_full": "Ce2 Mg1",
"formula_reduced": "Ce2Mg",
"formula_anonymous": "AB2",
"energy_above_hull": 1.2362953095238098,
"spacegroup": 139
},
{
"id": "jvasp-9149",
"created_at": "2022-09-04T14:37:11.079999Z",
"updated_at": "2022-09-04T14:37:11.080028Z",
"structure_string": "Th6 As8\n1.0\n7.279681 -0.000000 -2.573756\n-3.639841 6.304389 -2.573756\n0.000000 0.000000 7.721268\nTh As\n6 8\ndirect\n0.750000 0.875000 0.124999 Th\n0.625000 0.375000 0.250000 Th\n0.875000 0.125000 0.750000 Th\n0.125000 0.750000 0.875000 Th\n0.375000 0.250000 0.625000 Th\n0.250000 0.625000 0.375000 Th\n0.657167 0.657167 0.657166 As\n0.342833 0.500000 -0.000000 As\n0.500000 -0.000000 0.342833 As\n0.000000 0.342833 0.500000 As\n0.500000 -0.000000 0.842833 As\n0.000000 0.842833 0.500000 As\n0.157167 0.157167 0.157167 As\n0.842833 0.500000 -0.000001 As\n",
"nsites": 14,
"nelements": 2,
"elements": [
"Th",
"As"
],
"chemical_system": "As-Th",
"density": 9.332703960745938,
"density_atomic": 0.03950791016782782,
"volume": 354.3594166466571,
"volume_molar": 15.242873476268972,
"formula_full": "Th6 As8",
"formula_reduced": "Th3As4",
"formula_anonymous": "A3B4",
"energy_above_hull": 2.964471971428571,
"spacegroup": 220
}
]
}