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=-elements&page=3471",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-elements&page=3469",
"results": [
{
"id": "jvasp-101237",
"created_at": "2022-09-04T14:36:42.871318Z",
"updated_at": "2022-09-04T14:36:42.871345Z",
"structure_string": "Al4 Ge2 W3\n1.0\n4.866229 -0.000494 0.012746\n-2.438838 4.210969 0.012746\n-0.006757 -0.011720 6.729312\nAl Ge W\n4 2 3\ndirect\n0.153479 0.846521 0.500000 Al\n0.349664 0.174217 0.169595 Al\n0.825783 0.650337 0.830406 Al\n0.819681 0.180320 0.500000 Al\n0.694099 0.844302 0.170192 Ge\n0.155698 0.305902 0.829809 Ge\n0.029700 0.514659 0.159680 W\n0.485341 0.970301 0.840321 W\n0.486941 0.513059 0.500000 W\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Al",
"Ge",
"W"
],
"chemical_system": "Al-Ge-W",
"density": 9.691096496739828,
"density_atomic": 0.0652706914406343,
"volume": 137.88730901044272,
"volume_molar": 9.226408709761138,
"formula_full": "Al4 Ge2 W3",
"formula_reduced": "Al4Ge2W3",
"formula_anonymous": "A2B3C4",
"energy_above_hull": 4.220058122222223,
"spacegroup": 5
},
{
"id": "jvasp-102641",
"created_at": "2022-09-04T14:37:00.768503Z",
"updated_at": "2022-09-04T14:37:00.768532Z",
"structure_string": "Al6 Ge1 W1\n1.0\n5.044661 0.000000 0.000000\n0.000000 5.044661 0.000000\n-0.000000 0.000000 5.044661\nAl Ge W\n6 1 1\ndirect\n0.244544 0.000000 0.500000 Al\n0.755456 0.000000 0.500000 Al\n0.500000 0.244544 -0.000000 Al\n0.500000 0.755456 -0.000000 Al\n-0.000000 0.500000 0.244544 Al\n-0.000000 0.500000 0.755456 Al\n0.500000 0.500000 0.500000 Ge\n0.000000 0.000000 0.000000 W\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Al",
"Ge",
"W"
],
"chemical_system": "Al-Ge-W",
"density": 5.411440326123965,
"density_atomic": 0.06231520467198849,
"volume": 128.37958315486534,
"volume_molar": 9.66399900585905,
"formula_full": "Al6 Ge1 W1",
"formula_reduced": "Al6GeW",
"formula_anonymous": "ABC6",
"energy_above_hull": 2.735721593750001,
"spacegroup": 200
},
{
"id": "jvasp-40609",
"created_at": "2022-09-04T14:38:07.168384Z",
"updated_at": "2022-09-04T14:38:07.168397Z",
"structure_string": "Al1 Ge1 Ru2\n1.0\n0.000000 3.015863 3.015863\n3.015863 -0.000000 3.015863\n3.015863 3.015863 0.000000\nAl Ge Ru\n1 1 2\ndirect\n0.250001 0.250001 0.250001 Al\n0.750000 0.750000 0.750000 Ge\n0.000000 0.000000 0.000000 Ru\n0.499999 0.499999 0.499999 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ge",
"Ru"
],
"chemical_system": "Al-Ge-Ru",
"density": 9.133729795603415,
"density_atomic": 0.07291135479641038,
"volume": 54.86113940920668,
"volume_molar": 8.259537594405645,
"formula_full": "Al1 Ge1 Ru2",
"formula_reduced": "AlGeRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.7615449375,
"spacegroup": 225
},
{
"id": "jvasp-45396",
"created_at": "2022-09-04T14:37:06.455325Z",
"updated_at": "2022-09-04T14:37:06.455341Z",
"structure_string": "Al4 Ge4 O14\n1.0\n5.166484 -0.001359 -1.268531\n-0.761190 5.110103 -1.268531\n0.004569 0.005299 9.817912\nAl Ge O\n4 4 14\ndirect\n0.595630 0.748477 0.979419 Al\n0.251523 0.404370 0.520580 Al\n0.404369 0.251523 0.020580 Al\n0.748477 0.595630 0.479419 Al\n0.509407 0.007201 0.705123 Ge\n0.490593 0.992798 0.294877 Ge\n0.007201 0.509407 0.205123 Ge\n0.992798 0.490593 0.794877 Ge\n0.141035 0.278181 0.099635 O\n0.721818 0.858964 0.400365 O\n0.858964 0.721818 0.900365 O\n0.981947 0.437894 0.371835 O\n0.836386 0.163614 0.750000 O\n0.518790 0.681778 0.602911 O\n0.318221 0.481210 0.897089 O\n0.481210 0.318221 0.397089 O\n0.681778 0.518790 0.102911 O\n0.437894 0.981947 0.871835 O\n0.018052 0.562105 0.628165 O\n0.562105 0.018052 0.128165 O\n0.163613 0.836386 0.250000 O\n0.278181 0.141035 0.599635 O\n",
"nsites": 22,
"nelements": 3,
"elements": [
"Al",
"Ge",
"O"
],
"chemical_system": "Al-Ge-O",
"density": 3.9868480647546582,
"density_atomic": 0.08485538986927561,
"volume": 259.2646151752082,
"volume_molar": 7.0969454848742535,
"formula_full": "Al4 Ge4 O14",
"formula_reduced": "Al2Ge2O7",
"formula_anonymous": "A2B2C7",
"energy_above_hull": 2.1823065454545456,
"spacegroup": 15
},
{
"id": "jvasp-115127",
"created_at": "2022-09-04T14:38:42.985595Z",
"updated_at": "2022-09-04T14:38:42.985625Z",
"structure_string": "Al1 Ge1 O1\n1.0\n7.166974 -1.233181 0.000000\n-5.151566 3.293220 0.000000\n0.000000 0.000000 2.948398\nAl Ge O\n1 1 1\ndirect\n0.220944 -0.020462 0.000000 Al\n-0.013554 0.304367 0.000000 Ge\n0.792609 0.716094 0.000000 O\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"Ge",
"O"
],
"chemical_system": "Al-Ge-O",
"density": 3.7750284568974553,
"density_atomic": 0.058986943948658714,
"volume": 50.858712100954946,
"volume_molar": 10.2092774381422,
"formula_full": "Al1 Ge1 O1",
"formula_reduced": "AlGeO",
"formula_anonymous": "ABC",
"energy_above_hull": 1.08453075,
"spacegroup": 38
},
{
"id": "jvasp-110612",
"created_at": "2022-09-04T14:38:39.670567Z",
"updated_at": "2022-09-04T14:38:39.670588Z",
"structure_string": "Al3 Ge3 Mo3\n1.0\n4.865835 -0.000000 0.000000\n-2.432917 4.213936 -0.000000\n0.000000 -0.000000 6.724686\nAl Ge Mo\n3 3 3\ndirect\n0.666557 0.833279 0.000000 Al\n0.166721 0.833279 0.666667 Al\n0.166721 0.333443 0.333333 Al\n0.006482 0.503241 0.000000 Ge\n0.496759 0.503241 0.666667 Ge\n0.496759 0.993519 0.333333 Ge\n0.339086 0.169544 0.000000 Mo\n0.830455 0.169544 0.666667 Mo\n0.830455 0.660914 0.333333 Mo\n",
"nsites": 9,
"nelements": 3,
"elements": [
"Al",
"Ge",
"Mo"
],
"chemical_system": "Al-Ge-Mo",
"density": 7.065395443814232,
"density_atomic": 0.0652717393312878,
"volume": 137.88509532924118,
"volume_molar": 9.226260586430099,
"formula_full": "Al3 Ge3 Mo3",
"formula_reduced": "AlGeMo",
"formula_anonymous": "ABC",
"energy_above_hull": 2.43059155,
"spacegroup": 153
},
{
"id": "jvasp-115123",
"created_at": "2022-09-04T14:38:43.267338Z",
"updated_at": "2022-09-04T14:38:43.267363Z",
"structure_string": "Al2 Ge2 H2\n1.0\n3.111814 0.000000 -0.000000\n-1.555907 2.694910 0.000000\n-0.000000 -0.000000 9.579075\nAl Ge H\n2 2 2\ndirect\n0.666664 0.333333 0.142930 Al\n0.333331 0.666666 0.642929 Al\n0.333331 0.666666 0.923360 Ge\n0.666664 0.333333 0.423361 Ge\n0.000000 0.000000 0.183708 H\n0.000000 0.000000 0.683707 H\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Al",
"Ge",
"H"
],
"chemical_system": "Al-Ge-H",
"density": 4.16028272700143,
"density_atomic": 0.07469125908416657,
"volume": 80.33068492310247,
"volume_molar": 8.062711532568882,
"formula_full": "Al2 Ge2 H2",
"formula_reduced": "AlGeH",
"formula_anonymous": "ABC",
"energy_above_hull": 1.5642229166666666,
"spacegroup": 186
},
{
"id": "jvasp-115122",
"created_at": "2022-09-04T14:38:45.210400Z",
"updated_at": "2022-09-04T14:38:45.210428Z",
"structure_string": "Al1 Ge1 H1\n1.0\n-0.000000 2.920470 2.920470\n2.920470 0.000000 2.920470\n2.920470 2.920470 -0.000000\nAl Ge H\n1 1 1\ndirect\n0.000000 0.000000 0.000000 Al\n0.250000 0.250000 0.250000 Ge\n0.499999 0.499999 0.499999 H\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Al",
"Ge",
"H"
],
"chemical_system": "Al-Ge-H",
"density": 3.35417776834036,
"density_atomic": 0.06021892672905724,
"volume": 49.81822431837564,
"volume_molar": 10.000411975283773,
"formula_full": "Al1 Ge1 H1",
"formula_reduced": "AlGeH",
"formula_anonymous": "ABC",
"energy_above_hull": 1.69417625,
"spacegroup": 216
},
{
"id": "jvasp-101747",
"created_at": "2022-09-04T14:36:48.902137Z",
"updated_at": "2022-09-04T14:36:48.902168Z",
"structure_string": "Al4 Ga1 Sb5\n1.0\n5.990037 0.002302 -9.973745\n-0.232269 4.314358 -10.802245\n0.001686 -0.002302 11.634265\nAl Ga Sb\n4 1 5\ndirect\n0.400255 0.400180 0.000075 Al\n0.799880 0.800194 0.999689 Al\n0.199494 0.199807 0.999688 Al\n0.599895 0.599820 0.000076 Al\n0.000337 0.000000 0.000337 Ga\n0.750853 0.500000 0.250854 Sb\n0.150253 0.900208 0.250046 Sb\n0.549544 0.299946 0.249599 Sb\n0.949653 0.700054 0.249599 Sb\n0.349838 0.099792 0.250046 Sb\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Al",
"Ga",
"Sb"
],
"chemical_system": "Al-Ga-Sb",
"density": 4.344544636467701,
"density_atomic": 0.03326783327513875,
"volume": 300.59066117398936,
"volume_molar": 18.101992727312307,
"formula_full": "Al4 Ga1 Sb5",
"formula_reduced": "Al4GaSb5",
"formula_anonymous": "AB4C5",
"energy_above_hull": 1.6982914025000002,
"spacegroup": 44
},
{
"id": "jvasp-81193",
"created_at": "2022-09-04T14:37:09.404525Z",
"updated_at": "2022-09-04T14:37:09.404553Z",
"structure_string": "Al1 Ga1 Ru2\n1.0\n-8.847344 -0.000001 -5.108017\n-5.769445 0.278117 -0.223061\n-5.003369 2.444908 -1.549944\nAl Ga Ru\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 -0.000001 0.000000 Ga\n0.739932 -0.000002 0.000000 Ru\n0.260068 -0.000001 0.000000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ga",
"Ru"
],
"chemical_system": "Al-Ga-Ru",
"density": 7.761882959815718,
"density_atomic": 0.06256517449746579,
"volume": 63.933330836662506,
"volume_molar": 9.625387938850755,
"formula_full": "Al1 Ga1 Ru2",
"formula_reduced": "AlGaRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.67238403125,
"spacegroup": 71
},
{
"id": "jvasp-104554",
"created_at": "2022-09-04T14:36:54.356747Z",
"updated_at": "2022-09-04T14:36:54.356760Z",
"structure_string": "Al1 Ga1 Ru2\n1.0\n3.690913 -0.000000 2.130950\n1.230304 3.479826 2.130950\n-0.000000 -0.000000 4.261900\nAl Ga Ru\n1 1 2\ndirect\n0.499999 0.500001 0.500000 Al\n0.000000 0.000000 0.000000 Ga\n0.249999 0.250000 0.250000 Ru\n0.749998 0.750001 0.750001 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ga",
"Ru"
],
"chemical_system": "Al-Ga-Ru",
"density": 9.06566837845769,
"density_atomic": 0.07307442368956173,
"volume": 54.73871428658804,
"volume_molar": 8.241106061381405,
"formula_full": "Al1 Ga1 Ru2",
"formula_reduced": "AlGaRu2",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.44593403125,
"spacegroup": 225
},
{
"id": "jvasp-80883",
"created_at": "2022-09-04T14:37:15.875276Z",
"updated_at": "2022-09-04T14:37:15.875294Z",
"structure_string": "Al1 Ga1 Pd2\n1.0\n-6.350346 -2.745050 -8.149023\n-3.696776 -2.055537 -1.102444\n-2.429906 1.527713 -3.296729\nAl Ga Pd\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.499999 0.000001 0.000001 Ga\n0.749672 0.000305 0.000306 Pd\n0.250327 -0.000302 -0.000305 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Al",
"Ga",
"Pd"
],
"chemical_system": "Al-Ga-Pd",
"density": 8.69770587233027,
"density_atomic": 0.06768500495243752,
"volume": 59.0972845877874,
"volume_molar": 8.897304158035857,
"formula_full": "Al1 Ga1 Pd2",
"formula_reduced": "AlGaPd2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.9754466312500002,
"spacegroup": 225
}
]
}