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=-id&page=414",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-id&page=412",
"results": [
{
"id": "jvasp-90675",
"created_at": "2022-09-04T14:36:11.577141Z",
"updated_at": "2022-09-04T14:36:11.577163Z",
"structure_string": "U4 Co4\n1.0\n-3.158205 -3.158205 3.158205\n-3.158205 3.158205 -3.158205\n3.158205 -3.158205 -3.158205\nU Co\n4 4\ndirect\n0.569430 -0.000000 0.500001 U\n0.500001 0.569430 0.000000 U\n0.000000 0.500001 0.569430 U\n0.930572 0.930572 0.930572 U\n0.093433 -0.000000 0.500001 Co\n0.500001 0.093433 -0.000000 Co\n0.000000 0.500001 0.093433 Co\n0.406568 0.406568 0.406568 Co\n",
"nsites": 8,
"nelements": 2,
"elements": [
"U",
"Co"
],
"chemical_system": "Co-U",
"density": 15.654138797844862,
"density_atomic": 0.06349054358284344,
"volume": 126.00301633205389,
"volume_molar": 9.485098756702595,
"formula_full": "U4 Co4",
"formula_reduced": "UCo",
"formula_anonymous": "AB",
"energy_above_hull": 2.9196984500000003,
"spacegroup": 199
},
{
"id": "jvasp-90674",
"created_at": "2022-09-04T14:36:06.433590Z",
"updated_at": "2022-09-04T14:36:06.433608Z",
"structure_string": "K8\n1.0\n0.000000 -4.503570 0.000000\n-11.450892 0.000000 0.000000\n0.000000 0.000000 -11.349832\nK\n8\ndirect\n0.750000 0.493428 0.681397 K\n0.750000 0.993427 0.818603 K\n0.250000 0.506572 0.318603 K\n0.250000 0.006572 0.181397 K\n0.750000 0.318410 0.022419 K\n0.750000 0.818410 0.477581 K\n0.250000 0.681589 0.977581 K\n0.250000 0.181589 0.522419 K\n",
"nsites": 8,
"nelements": 1,
"elements": [
"K"
],
"chemical_system": "K",
"density": 0.8873833787378461,
"density_atomic": 0.013667979468903902,
"volume": 585.3096295762549,
"volume_molar": 44.06021221864582,
"formula_full": "K8",
"formula_reduced": "K",
"formula_anonymous": "A",
"energy_above_hull": 0.0345499999999998,
"spacegroup": 62
},
{
"id": "jvasp-90673",
"created_at": "2022-09-04T14:36:02.858720Z",
"updated_at": "2022-09-04T14:36:02.858742Z",
"structure_string": "Zr2 Ga6\n1.0\n3.986557 -0.000000 -0.000000\n-0.000000 3.986557 -0.000000\n-1.993278 -1.993278 8.803308\nZr Ga\n2 6\ndirect\n0.882017 0.882017 0.764034 Zr\n0.117983 0.117983 0.235966 Zr\n0.500000 0.000000 0.000000 Ga\n0.000000 0.500000 0.000000 Ga\n0.250000 0.750000 0.500000 Ga\n0.750000 0.250000 0.500000 Ga\n0.623721 0.623721 0.247441 Ga\n0.376280 0.376280 0.752560 Ga\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Zr",
"Ga"
],
"chemical_system": "Ga-Zr",
"density": 7.130615986507463,
"density_atomic": 0.0571805244344494,
"volume": 139.90777592764192,
"volume_molar": 10.531804000684991,
"formula_full": "Zr2 Ga6",
"formula_reduced": "ZrGa3",
"formula_anonymous": "AB3",
"energy_above_hull": 0.63207036875,
"spacegroup": 139
},
{
"id": "jvasp-90672",
"created_at": "2022-09-04T14:35:58.424858Z",
"updated_at": "2022-09-04T14:35:58.424890Z",
"structure_string": "Ti4 Si2 C2\n1.0\n-1.532498 -2.654344 0.000000\n-1.532498 2.654344 -0.000000\n0.000000 -0.000000 -12.850448\nTi Si C\n4 2 2\ndirect\n0.666668 0.333333 0.591494 Ti\n0.333333 0.666668 0.408506 Ti\n0.333333 0.666668 0.091494 Ti\n0.666668 0.333333 0.908506 Ti\n0.666673 0.333329 0.250000 Si\n0.333329 0.666673 0.750000 Si\n0.000000 0.000000 0.500000 C\n0.000000 0.000000 0.000000 C\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Ti",
"Si",
"C"
],
"chemical_system": "C-Si-Ti",
"density": 4.314893156712192,
"density_atomic": 0.07652169830585948,
"volume": 104.54551032079509,
"volume_molar": 7.8698472372232615,
"formula_full": "Ti4 Si2 C2",
"formula_reduced": "Ti2SiC",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.995336316666667,
"spacegroup": 194
},
{
"id": "jvasp-90671",
"created_at": "2022-09-04T14:35:52.726756Z",
"updated_at": "2022-09-04T14:35:52.726787Z",
"structure_string": "Pr2 Fe2 Sb4\n1.0\n4.363156 -0.000000 -0.000000\n0.000000 4.363156 0.000000\n-0.000000 -0.000000 10.029946\nPr Fe Sb\n2 2 4\ndirect\n0.750001 0.750001 0.743671 Pr\n0.250000 0.250000 0.256330 Pr\n0.250000 0.750001 0.500000 Fe\n0.750001 0.250000 0.500000 Fe\n0.250000 0.750001 0.000000 Sb\n0.750001 0.250000 0.000000 Sb\n0.750001 0.750001 0.368566 Sb\n0.250000 0.250000 0.631434 Sb\n",
"nsites": 8,
"nelements": 3,
"elements": [
"Pr",
"Fe",
"Sb"
],
"chemical_system": "Fe-Pr-Sb",
"density": 7.657741888568563,
"density_atomic": 0.041897673700735064,
"volume": 190.94138870673495,
"volume_molar": 14.373448996272906,
"formula_full": "Pr2 Fe2 Sb4",
"formula_reduced": "PrFeSb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.9532768875,
"spacegroup": 129
},
{
"id": "jvasp-90670",
"created_at": "2022-09-04T14:35:48.994596Z",
"updated_at": "2022-09-04T14:35:48.994615Z",
"structure_string": "N4 O4\n1.0\n2.603770 2.582048 -1.190235\n2.603770 -2.582048 -1.190235\n-0.597845 0.000000 -7.480262\nN O\n4 4\ndirect\n0.839778 0.160221 0.249999 N\n0.160221 0.839777 0.749999 N\n0.586936 0.413063 0.249999 N\n0.413063 0.586936 0.749999 N\n0.632089 0.687410 0.114227 O\n0.312589 0.367911 0.385772 O\n0.367910 0.312589 0.885772 O\n0.687410 0.632088 0.614227 O\n",
"nsites": 8,
"nelements": 2,
"elements": [
"N",
"O"
],
"chemical_system": "N-O",
"density": 1.9117063770585123,
"density_atomic": 0.0767348299073488,
"volume": 104.25513433286245,
"volume_molar": 7.84798867381508,
"formula_full": "N4 O4",
"formula_reduced": "NO",
"formula_anonymous": "AB",
"energy_above_hull": 2.9323633750000004,
"spacegroup": 15
},
{
"id": "jvasp-90668",
"created_at": "2022-09-04T14:35:46.184865Z",
"updated_at": "2022-09-04T14:35:46.184891Z",
"structure_string": "Zn1 Cu2 Sn1 S4\n1.0\n5.458983 -0.000000 -0.000000\n0.000000 5.458983 0.000000\n-2.729492 -2.729492 5.455373\nZn Cu Sn S\n1 2 1 4\ndirect\n0.750000 0.250000 0.500000 Zn\n0.000000 0.000000 0.000000 Cu\n0.250000 0.750000 0.500000 Cu\n0.500000 0.500000 0.000000 Sn\n0.364064 0.888171 0.258998 S\n0.894933 0.370827 0.258998 S\n0.111828 0.105066 0.741002 S\n0.629173 0.635936 0.741002 S\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Zn",
"Cu",
"Sn",
"S"
],
"chemical_system": "Cu-S-Sn-Zn",
"density": 4.488811680157378,
"density_atomic": 0.04920871828608776,
"volume": 162.57281796062856,
"volume_molar": 12.237954918859517,
"formula_full": "Zn1 Cu2 Sn1 S4",
"formula_reduced": "ZnCu2SnS4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.746070375,
"spacegroup": 82
},
{
"id": "jvasp-90665",
"created_at": "2022-09-04T14:36:19.644894Z",
"updated_at": "2022-09-04T14:36:19.644919Z",
"structure_string": "Hf2 Cu2 Si2 As2\n1.0\n3.654419 0.000000 0.000000\n-0.000000 3.654419 0.000000\n0.000000 0.000000 9.721783\nHf Cu Si As\n2 2 2 2\ndirect\n0.750000 0.750000 0.781463 Hf\n0.250000 0.250000 0.218537 Hf\n0.250000 0.750000 0.500000 Cu\n0.750000 0.250000 0.500000 Cu\n0.250000 0.750000 0.000000 Si\n0.750000 0.250000 0.000000 Si\n0.750000 0.750000 0.317345 As\n0.250000 0.250000 0.682655 As\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Hf",
"Cu",
"Si",
"As"
],
"chemical_system": "As-Cu-Hf-Si",
"density": 8.826120181860743,
"density_atomic": 0.06161796960230235,
"volume": 129.83225594147265,
"volume_molar": 9.773351505848684,
"formula_full": "Hf2 Cu2 Si2 As2",
"formula_reduced": "HfCuSiAs",
"formula_anonymous": "ABCD",
"energy_above_hull": 2.49866345,
"spacegroup": 129
},
{
"id": "jvasp-90663",
"created_at": "2022-09-04T14:36:13.772981Z",
"updated_at": "2022-09-04T14:36:13.773002Z",
"structure_string": "Cu2 Sn1 Hg1 Te4\n1.0\n6.314310 -0.000000 0.000000\n-0.000000 6.314310 0.000000\n-3.157156 -3.157156 6.226754\nCu Sn Hg Te\n2 1 1 4\ndirect\n0.749999 0.249999 0.500000 Cu\n0.249999 0.749999 0.500000 Cu\n0.500000 0.500000 -0.000000 Sn\n0.000000 0.000000 0.000000 Hg\n0.891083 0.891083 0.286079 Te\n0.394997 0.394997 0.286079 Te\n0.108916 0.605002 0.713920 Te\n0.605002 0.108916 0.713920 Te\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Cu",
"Sn",
"Hg",
"Te"
],
"chemical_system": "Cu-Hg-Sn-Te",
"density": 6.399604351941225,
"density_atomic": 0.03222377965452638,
"volume": 248.26386245712376,
"volume_molar": 18.688499066725985,
"formula_full": "Cu2 Sn1 Hg1 Te4",
"formula_reduced": "Cu2SnHgTe4",
"formula_anonymous": "ABC2D4",
"energy_above_hull": 0.2127722833333334,
"spacegroup": 121
},
{
"id": "jvasp-90660",
"created_at": "2022-09-04T14:36:08.387994Z",
"updated_at": "2022-09-04T14:36:08.388021Z",
"structure_string": "Sr2 Fe2 As2 F2\n1.0\n-3.986141 0.000000 0.015027\n-0.014958 0.000000 -3.986508\n0.000000 -8.757915 0.000000\nSr Fe As F\n2 2 2 2\ndirect\n0.750000 0.250000 0.166402 Sr\n0.250000 0.750000 0.833598 Sr\n0.750000 0.750000 0.500010 Fe\n0.250000 0.250000 0.499990 Fe\n0.750000 0.250000 0.640457 As\n0.250000 0.750000 0.359543 As\n0.750000 0.750000 0.000024 F\n0.250000 0.250000 0.999975 F\n",
"nsites": 8,
"nelements": 4,
"elements": [
"Sr",
"Fe",
"As",
"F"
],
"chemical_system": "As-F-Fe-Sr",
"density": 5.664742935856658,
"density_atomic": 0.057482787675499594,
"volume": 139.1720952219889,
"volume_molar": 10.47642434113676,
"formula_full": "Sr2 Fe2 As2 F2",
"formula_reduced": "SrFeAsF",
"formula_anonymous": "ABCD",
"energy_above_hull": 0.773475960625,
"spacegroup": 129
},
{
"id": "jvasp-90659",
"created_at": "2022-09-04T14:35:59.493627Z",
"updated_at": "2022-09-04T14:35:59.493661Z",
"structure_string": "Mn6 Ge2\n1.0\n0.000000 -0.000000 -4.159790\n-2.576363 -4.462672 0.000000\n-2.576363 4.462672 -0.000000\nMn Ge\n6 2\ndirect\n0.750000 0.160365 0.320702 Mn\n0.750000 0.160376 0.839623 Mn\n0.750000 0.679297 0.839634 Mn\n0.250000 0.839634 0.679297 Mn\n0.250000 0.839623 0.160376 Mn\n0.250000 0.320702 0.160365 Mn\n0.750000 0.666672 0.333327 Ge\n0.250000 0.333327 0.666672 Ge\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Mn",
"Ge"
],
"chemical_system": "Ge-Mn",
"density": 8.244330740267852,
"density_atomic": 0.08363471153205308,
"volume": 95.65406340803833,
"volume_molar": 7.200527926364652,
"formula_full": "Mn6 Ge2",
"formula_reduced": "Mn3Ge",
"formula_anonymous": "AB3",
"energy_above_hull": 3.377454418534483,
"spacegroup": 194
},
{
"id": "jvasp-90658",
"created_at": "2022-09-04T14:35:48.223900Z",
"updated_at": "2022-09-04T14:35:48.223936Z",
"structure_string": "Eu2 As6\n1.0\n0.150932 0.000000 5.477305\n-4.247394 3.798652 1.617975\n-4.247394 -3.798652 1.617975\nEu As\n2 6\ndirect\n0.677506 0.175158 0.175158 Eu\n0.322495 0.824842 0.824842 Eu\n0.218818 0.332790 0.929017 As\n0.218818 0.929017 0.332790 As\n0.781184 0.667209 0.070982 As\n0.781184 0.070982 0.667209 As\n0.235180 0.490184 0.490184 As\n0.764821 0.509816 0.509816 As\n",
"nsites": 8,
"nelements": 2,
"elements": [
"Eu",
"As"
],
"chemical_system": "As-Eu",
"density": 7.005254599186526,
"density_atomic": 0.04479257149495068,
"volume": 178.60104327570954,
"volume_molar": 13.444507781114682,
"formula_full": "Eu2 As6",
"formula_reduced": "EuAs3",
"formula_anonymous": "AB3",
"energy_above_hull": 1.9464813125,
"spacegroup": 12
}
]
}