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=-formula_anonymous&page=3671",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-formula_anonymous&page=3669",
"results": [
{
"id": "jvasp-16849",
"created_at": "2022-09-04T14:38:30.743157Z",
"updated_at": "2022-09-04T14:38:30.743172Z",
"structure_string": "Sr1 Cd2 Ga2\n1.0\n4.284813 0.000000 -1.575398\n-0.579228 4.245482 -1.575398\n-0.018900 -0.021652 6.563272\nSr Cd Ga\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.749999 0.250000 0.499999 Cd\n0.249999 0.750000 0.499999 Cd\n0.609122 0.609123 0.218245 Ga\n0.390877 0.390877 0.781754 Ga\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"Cd",
"Ga"
],
"chemical_system": "Cd-Ga-Sr",
"density": 6.300358536524066,
"density_atomic": 0.04198124973281803,
"volume": 119.10078980072255,
"volume_molar": 14.34483441614247,
"formula_full": "Sr1 Cd2 Ga2",
"formula_reduced": "Sr(CdGa)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.0,
"spacegroup": 139
},
{
"id": "jvasp-56572",
"created_at": "2022-09-04T14:38:35.175883Z",
"updated_at": "2022-09-04T14:38:35.175902Z",
"structure_string": "Er1 Ge2 Rh2\n1.0\n3.865169 0.000000 -1.443386\n-0.539010 3.827401 -1.443386\n0.006912 0.007954 5.915370\nEr Ge Rh\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.379370 0.379369 0.758741 Ge\n0.620630 0.620629 0.241258 Ge\n0.250000 0.749999 0.499999 Rh\n0.750000 0.249999 0.499999 Rh\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Er",
"Ge",
"Rh"
],
"chemical_system": "Er-Ge-Rh",
"density": 9.82601934004343,
"density_atomic": 0.05707887681747177,
"volume": 87.59807968872832,
"volume_molar": 10.550559323824379,
"formula_full": "Er1 Ge2 Rh2",
"formula_reduced": "Er(GeRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.6984135799999998,
"spacegroup": 139
},
{
"id": "jvasp-4993",
"created_at": "2022-09-04T14:38:35.660561Z",
"updated_at": "2022-09-04T14:38:35.660585Z",
"structure_string": "Ag4 Pb2 O4\n1.0\n5.323629 -0.312682 -3.038513\n-3.396532 5.464443 0.107919\n-0.101062 0.104980 6.433271\nAg Pb O\n4 2 4\ndirect\n0.500000 0.500000 0.000000 Ag\n0.000000 0.500000 0.500000 Ag\n0.000000 0.500000 0.000000 Ag\n0.500000 0.000000 0.000000 Ag\n0.250000 0.120922 0.379078 Pb\n0.750001 0.879077 0.620923 Pb\n0.624715 0.136469 0.750075 O\n0.375286 0.863531 0.249926 O\n0.875286 0.749925 0.363532 O\n0.124714 0.250075 0.636469 O\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ag",
"Pb",
"O"
],
"chemical_system": "Ag-O-Pb",
"density": 8.409434920781404,
"density_atomic": 0.055659356346251215,
"volume": 179.66431264118495,
"volume_molar": 10.819637802738631,
"formula_full": "Ag4 Pb2 O4",
"formula_reduced": "Ag2PbO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.8349144679999996,
"spacegroup": 15
},
{
"id": "jvasp-26856",
"created_at": "2022-09-04T14:38:32.000754Z",
"updated_at": "2022-09-04T14:38:32.000784Z",
"structure_string": "Ce2 P4 Rh4\n1.0\n4.181216 -0.000000 0.000000\n-0.000000 4.181216 -0.000000\n0.000000 -0.000000 9.494698\nCe P Rh\n2 4 4\ndirect\n0.000000 0.500000 0.744457 Ce\n0.500000 0.000000 0.255543 Ce\n0.000000 0.500000 0.138255 P\n0.500000 0.000000 0.861746 P\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.500000 P\n0.000000 0.500000 0.386932 Rh\n0.500000 0.000000 0.613068 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.000000 0.000000 Rh\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Ce",
"P",
"Rh"
],
"chemical_system": "Ce-P-Rh",
"density": 8.160547749017958,
"density_atomic": 0.06024397743492113,
"volume": 165.99169619573263,
"volume_molar": 9.996253594818585,
"formula_full": "Ce2 P4 Rh4",
"formula_reduced": "Ce(PRh)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.7451945,
"spacegroup": 129
},
{
"id": "jvasp-108709",
"created_at": "2022-09-04T14:38:20.532787Z",
"updated_at": "2022-09-04T14:38:20.532803Z",
"structure_string": "La1 P2 Pd2\n1.0\n3.940294 -0.012311 -4.294480\n-0.605993 3.893435 -4.294480\n0.010577 0.012311 5.828238\nLa P Pd\n1 2 2\ndirect\n0.000000 0.000000 0.000000 La\n0.386325 0.386325 0.000000 P\n0.613675 0.613676 0.000001 P\n0.750000 0.250000 0.500000 Pd\n0.250001 0.750001 0.500001 Pd\n",
"nsites": 5,
"nelements": 3,
"elements": [
"La",
"P",
"Pd"
],
"chemical_system": "La-P-Pd",
"density": 7.650930108838515,
"density_atomic": 0.055687404360865465,
"volume": 89.78691065575627,
"volume_molar": 10.814188287490165,
"formula_full": "La1 P2 Pd2",
"formula_reduced": "La(PPd)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.1756954800000003,
"spacegroup": 139
},
{
"id": "jvasp-16732",
"created_at": "2022-09-04T14:38:30.663171Z",
"updated_at": "2022-09-04T14:38:30.663198Z",
"structure_string": "Sm1 Si2 Ir2\n1.0\n3.853772 -0.000000 -1.448635\n-0.544542 3.815106 -1.448635\n-0.010563 -0.012178 5.822269\nSm Si Ir\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Sm\n0.622676 0.622676 0.245352 Si\n0.377325 0.377324 0.754650 Si\n0.750000 0.250000 0.500001 Ir\n0.250001 0.750000 0.500001 Ir\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sm",
"Si",
"Ir"
],
"chemical_system": "Ir-Si-Sm",
"density": 11.481968487281803,
"density_atomic": 0.05850264436657896,
"volume": 85.46622215347875,
"volume_molar": 10.29379240067359,
"formula_full": "Sm1 Si2 Ir2",
"formula_reduced": "Sm(SiIr)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.425211655,
"spacegroup": 139
},
{
"id": "jvasp-59046",
"created_at": "2022-09-04T14:38:30.681026Z",
"updated_at": "2022-09-04T14:38:30.681057Z",
"structure_string": "Ag8 Hg4 O8\n1.0\n6.270466 0.000000 0.000000\n0.000000 6.270466 0.000000\n0.000000 0.000000 8.435795\nAg Hg O\n8 4 8\ndirect\n0.499453 0.745473 0.628401 Ag\n0.999453 0.754528 0.621598 Ag\n0.245473 0.000547 0.878401 Ag\n0.754528 0.999453 0.378401 Ag\n0.254527 0.500547 0.871598 Ag\n0.000547 0.245473 0.121599 Ag\n0.500547 0.254527 0.128401 Ag\n0.745473 0.499453 0.371598 Ag\n0.789642 0.789642 0.000000 Hg\n0.710359 0.289642 0.750000 Hg\n0.289642 0.710359 0.250000 Hg\n0.210359 0.210359 0.500000 Hg\n0.249536 0.623154 0.486221 O\n0.750465 0.376846 0.986220 O\n0.623154 0.249536 0.513779 O\n0.123154 0.250464 0.736221 O\n0.749536 0.876847 0.763779 O\n0.376846 0.750465 0.013779 O\n0.876847 0.749536 0.236221 O\n0.250464 0.123154 0.263779 O\n",
"nsites": 20,
"nelements": 3,
"elements": [
"Ag",
"Hg",
"O"
],
"chemical_system": "Ag-Hg-O",
"density": 8.977937705987896,
"density_atomic": 0.06029819940821394,
"volume": 331.68486283647735,
"volume_molar": 9.987264659812798,
"formula_full": "Ag8 Hg4 O8",
"formula_reduced": "Ag2HgO2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5094312240000003,
"spacegroup": 96
},
{
"id": "jvasp-54940",
"created_at": "2022-09-04T14:38:32.024282Z",
"updated_at": "2022-09-04T14:38:32.024309Z",
"structure_string": "Ba1 Cr2 As2\n1.0\n3.944590 -0.000000 -1.103544\n-0.308729 3.932490 -1.103544\n-0.129600 -0.140174 7.138436\nBa Cr As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.750000 0.500001 Cr\n0.750000 0.250000 0.500001 Cr\n0.353317 0.353318 0.706635 As\n0.646683 0.646683 0.293367 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Cr",
"As"
],
"chemical_system": "As-Ba-Cr",
"density": 5.9312537080028465,
"density_atomic": 0.0456573084800696,
"volume": 109.51149260545237,
"volume_molar": 13.189872466154668,
"formula_full": "Ba1 Cr2 As2",
"formula_reduced": "Ba(CrAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 2.8821248540000006,
"spacegroup": 139
},
{
"id": "jvasp-56749",
"created_at": "2022-09-04T14:38:35.191735Z",
"updated_at": "2022-09-04T14:38:35.191765Z",
"structure_string": "Tm1 Cr2 Si2\n1.0\n3.614320 0.000000 -1.241114\n-0.426184 3.589104 -1.241114\n0.033908 0.038172 5.982035\nTm Cr Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.250001 0.749999 0.500000 Cr\n0.750001 0.249999 0.500000 Cr\n0.385904 0.385902 0.771804 Si\n0.614098 0.614096 0.228196 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Tm",
"Cr",
"Si"
],
"chemical_system": "Cr-Si-Tm",
"density": 7.011316192266866,
"density_atomic": 0.06414990175293342,
"volume": 77.94244205169592,
"volume_molar": 9.38760714426912,
"formula_full": "Tm1 Cr2 Si2",
"formula_reduced": "Tm(CrSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.5851272499999998,
"spacegroup": 139
},
{
"id": "jvasp-118316",
"created_at": "2022-09-04T14:38:32.603587Z",
"updated_at": "2022-09-04T14:38:32.603625Z",
"structure_string": "Sr2 O2 F1\n1.0\n-1.931975 1.931975 6.307460\n1.931975 -1.931975 6.307460\n1.931975 1.931975 -6.307460\nSr O F\n2 2 1\ndirect\n0.859407 0.859407 0.000000 Sr\n0.140592 0.140592 0.000000 Sr\n0.250000 0.750001 0.500001 O\n0.750001 0.250000 0.500001 O\n0.500000 0.500000 0.000000 F\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Sr",
"O",
"F"
],
"chemical_system": "F-O-Sr",
"density": 3.9892901054314067,
"density_atomic": 0.05309486286048062,
"volume": 94.17106911338465,
"volume_molar": 11.342228674409814,
"formula_full": "Sr2 O2 F1",
"formula_reduced": "Sr2O2F",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.3751659619999998,
"spacegroup": 139
},
{
"id": "jvasp-21451",
"created_at": "2022-09-04T14:38:31.132166Z",
"updated_at": "2022-09-04T14:38:31.132192Z",
"structure_string": "Sr2 B4 Ir4\n1.0\n5.433096 0.006193 -1.492458\n-2.842905 4.629953 -1.492458\n-0.007826 -0.014008 6.188154\nSr B Ir\n2 4 4\ndirect\n0.875000 0.124999 0.249999 Sr\n0.125000 0.874999 0.749999 Sr\n0.549397 0.450602 0.249999 B\n0.799397 0.200602 0.749999 B\n0.200603 0.799396 0.249999 B\n0.450603 0.549396 0.749999 B\n0.506350 0.756349 0.512699 Ir\n0.756350 0.506349 0.012699 Ir\n0.493650 0.243649 0.487299 Ir\n0.243650 0.493649 0.987299 Ir\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Sr",
"B",
"Ir"
],
"chemical_system": "B-Ir-Sr",
"density": 10.540606231643231,
"density_atomic": 0.0642901563420391,
"volume": 155.54480761872148,
"volume_molar": 9.367127259670612,
"formula_full": "Sr2 B4 Ir4",
"formula_reduced": "Sr(BIr)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 3.6233727353333336,
"spacegroup": 70
},
{
"id": "jvasp-21082",
"created_at": "2022-09-04T14:38:32.169408Z",
"updated_at": "2022-09-04T14:38:32.169443Z",
"structure_string": "Nd2 B4 C4\n1.0\n5.389272 0.000000 0.000000\n-0.000000 5.389272 0.000000\n0.000000 0.000000 3.835037\nNd B C\n2 4 4\ndirect\n0.500000 0.500000 0.000000 Nd\n0.000000 0.000000 0.000000 Nd\n0.138296 0.638296 0.500000 B\n0.638296 0.861703 0.500000 B\n0.861703 0.361703 0.500000 B\n0.361703 0.138296 0.500000 B\n0.839420 0.660580 0.500000 C\n0.339420 0.839420 0.500000 C\n0.660580 0.160580 0.500000 C\n0.160580 0.339420 0.500000 C\n",
"nsites": 10,
"nelements": 3,
"elements": [
"Nd",
"B",
"C"
],
"chemical_system": "B-C-Nd",
"density": 5.661622415235289,
"density_atomic": 0.08977806383824301,
"volume": 111.38578370343816,
"volume_molar": 6.707808681250187,
"formula_full": "Nd2 B4 C4",
"formula_reduced": "Nd(BC)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 4.7282313333333335,
"spacegroup": 127
}
]
}