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=-structure_string&page=4343",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=4341",
"results": [
{
"id": "jvasp-123375",
"created_at": "2022-09-04T14:38:50.525608Z",
"updated_at": "2022-09-04T14:38:50.525637Z",
"structure_string": "Ba1 Zr1\n1.0\n1.754326 -3.038578 0.000000\n1.754326 3.038578 0.000000\n0.000000 0.000000 6.082093\nBa Zr\n1 1\ndirect\n0.666668 0.333334 0.250000 Ba\n0.333334 0.666668 0.750000 Zr\n",
"nsites": 2,
"nelements": 2,
"elements": [
"Ba",
"Zr"
],
"chemical_system": "Ba-Zr",
"density": 5.852864664529876,
"density_atomic": 0.030843684666625498,
"volume": 64.84309581092644,
"volume_molar": 19.524712514378272,
"formula_full": "Ba1 Zr1",
"formula_reduced": "BaZr",
"formula_anonymous": "AB",
"energy_above_hull": 1.6887452350000005,
"spacegroup": 187
},
{
"id": "jvasp-65737",
"created_at": "2022-09-04T14:36:08.035732Z",
"updated_at": "2022-09-04T14:36:08.035753Z",
"structure_string": "Ba1 Zn4 Br1\n1.0\n0.000000 4.216839 4.216839\n4.216839 0.000000 4.216839\n4.216839 4.216839 -0.000000\nBa Zn Br\n1 4 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.115973 0.628009 0.628009 Zn\n0.628009 0.628009 0.628009 Zn\n0.628009 0.115973 0.628009 Zn\n0.628009 0.628009 0.115973 Zn\n0.000000 0.000000 0.000000 Br\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Br"
],
"chemical_system": "Ba-Br-Zn",
"density": 5.302405679465352,
"density_atomic": 0.040009230177981046,
"volume": 149.96539481787082,
"volume_molar": 15.051878612036546,
"formula_full": "Ba1 Zn4 Br1",
"formula_reduced": "BaZn4Br",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-92711",
"created_at": "2022-09-04T14:35:57.514746Z",
"updated_at": "2022-09-04T14:35:57.514767Z",
"structure_string": "Ba1 Zn2 Si2\n1.0\n4.552118 0.000000 -0.000000\n0.000000 4.552118 0.000000\n-2.276059 -2.276059 5.099229\nBa Zn Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.620611 0.620611 0.241222 Si\n0.379389 0.379389 0.758778 Si\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Si"
],
"chemical_system": "Ba-Si-Zn",
"density": 5.0966631819477355,
"density_atomic": 0.04731931680614823,
"volume": 105.66509276715395,
"volume_molar": 12.72660124124518,
"formula_full": "Ba1 Zn2 Si2",
"formula_reduced": "Ba(ZnSi)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.5448527939999999,
"spacegroup": 139
},
{
"id": "jvasp-65474",
"created_at": "2022-09-04T14:35:42.554527Z",
"updated_at": "2022-09-04T14:35:42.554553Z",
"structure_string": "Ba1 Zn2 Ru1\n1.0\n3.342185 0.000000 0.000000\n0.000000 3.342185 -0.000000\n0.000000 -0.000000 7.408748\nBa Zn Ru\n1 2 1\ndirect\n0.499999 0.499999 0.000000 Ba\n0.000000 0.000000 0.667176 Zn\n0.000000 0.000000 0.332825 Zn\n0.499999 0.499999 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Ru"
],
"chemical_system": "Ba-Ru-Zn",
"density": 7.40836957814189,
"density_atomic": 0.04833416239003292,
"volume": 82.75720116388833,
"volume_molar": 12.459387857814283,
"formula_full": "Ba1 Zn2 Ru1",
"formula_reduced": "BaZn2Ru",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2969193175000001,
"spacegroup": 123
},
{
"id": "jvasp-65517",
"created_at": "2022-09-04T14:36:11.837374Z",
"updated_at": "2022-09-04T14:36:11.837390Z",
"structure_string": "Ba1 Zn2 Ru1\n1.0\n3.342137 0.000000 0.000000\n-0.000000 3.342550 0.000000\n0.000000 0.000000 7.408165\nBa Zn Ru\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.667168 Zn\n0.000000 0.000000 0.332832 Zn\n0.500000 0.500000 0.500000 Ru\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Ru"
],
"chemical_system": "Ba-Ru-Zn",
"density": 7.408249947201194,
"density_atomic": 0.0483333818861375,
"volume": 82.75853755532965,
"volume_molar": 12.459589056248536,
"formula_full": "Ba1 Zn2 Ru1",
"formula_reduced": "BaZn2Ru",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2969118175,
"spacegroup": 123
},
{
"id": "jvasp-69060",
"created_at": "2022-09-04T14:36:16.499678Z",
"updated_at": "2022-09-04T14:36:16.499720Z",
"structure_string": "Ba1 Zn2 Re1\n1.0\n4.557974 0.000000 0.000000\n0.000000 4.557974 0.000000\n0.000000 0.000000 4.268348\nBa Zn Re\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.500000 0.000000 0.000000 Zn\n0.000000 0.500000 -0.000000 Zn\n0.000000 0.000000 0.500000 Re\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Re"
],
"chemical_system": "Ba-Re-Zn",
"density": 8.508206738549838,
"density_atomic": 0.04510830247247444,
"volume": 88.6754717147878,
"volume_molar": 13.35040431564627,
"formula_full": "Ba1 Zn2 Re1",
"formula_reduced": "BaZn2Re",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.1102961924999997,
"spacegroup": 123
},
{
"id": "jvasp-15805",
"created_at": "2022-09-04T14:36:51.344784Z",
"updated_at": "2022-09-04T14:36:51.344812Z",
"structure_string": "Ba1 Zn2 P2\n1.0\n3.882189 -0.000000 -1.128567\n-0.328079 3.868301 -1.128567\n-0.004218 -0.004592 7.226993\nBa Zn P\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.750000 0.499999 Zn\n0.750000 0.250000 0.499999 Zn\n0.639118 0.639118 0.278236 P\n0.360882 0.360882 0.721763 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"P"
],
"chemical_system": "Ba-P-Zn",
"density": 5.052324583332698,
"density_atomic": 0.046086790224537724,
"volume": 108.4909575095095,
"volume_molar": 13.066956346188904,
"formula_full": "Ba1 Zn2 P2",
"formula_reduced": "Ba(ZnP)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.400423554,
"spacegroup": 139
},
{
"id": "jvasp-65693",
"created_at": "2022-09-04T14:36:19.924927Z",
"updated_at": "2022-09-04T14:36:19.924956Z",
"structure_string": "Ba1 Zn2 Os1\n1.0\n4.528930 0.000000 0.000000\n0.000000 4.528930 0.000000\n0.000000 0.000000 4.320323\nBa Zn Os\n1 2 1\ndirect\n0.000000 0.000000 0.500000 Ba\n0.500000 0.000000 0.000000 Zn\n0.000000 0.500000 -0.000000 Zn\n0.500000 0.500000 0.500000 Os\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Os"
],
"chemical_system": "Ba-Os-Zn",
"density": 8.5893952335392,
"density_atomic": 0.04513906487703014,
"volume": 88.61503912181121,
"volume_molar": 13.341305976111347,
"formula_full": "Ba1 Zn2 Os1",
"formula_reduced": "BaZn2Os",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.8250129425000001,
"spacegroup": 123
},
{
"id": "jvasp-106161",
"created_at": "2022-09-04T14:35:54.859041Z",
"updated_at": "2022-09-04T14:35:54.859061Z",
"structure_string": "Ba1 Zn2 N2\n1.0\n3.647381 0.000000 -0.000004\n-1.823693 3.158726 -0.000000\n0.000000 0.000000 6.598153\nBa Zn N\n1 2 2\ndirect\n-0.000000 -0.000000 0.500000 Ba\n0.666667 0.333333 0.121301 Zn\n0.333334 0.666668 0.878699 Zn\n0.666667 0.333333 0.791466 N\n0.333334 0.666668 0.208534 N\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"N"
],
"chemical_system": "Ba-N-Zn",
"density": 6.469305854451824,
"density_atomic": 0.06577404268875099,
"volume": 76.01783006801747,
"volume_molar": 9.155801458787233,
"formula_full": "Ba1 Zn2 N2",
"formula_reduced": "Ba(ZnN)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 1.4164866539999998,
"spacegroup": 164
},
{
"id": "jvasp-56446",
"created_at": "2022-09-04T14:37:28.671458Z",
"updated_at": "2022-09-04T14:37:28.671479Z",
"structure_string": "Ba1 Zn2 As2\n1.0\n3.991188 0.000000 -1.158880\n-0.336492 3.976979 -1.158880\n-0.011189 -0.012176 7.413744\nBa Zn As\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Ba\n0.250000 0.750000 0.500000 Zn\n0.750000 0.250000 0.500000 Zn\n0.635609 0.635608 0.271215 As\n0.364392 0.364391 0.728784 As\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"As"
],
"chemical_system": "As-Ba-Zn",
"density": 5.903858387658954,
"density_atomic": 0.042529748746346824,
"volume": 117.56476695455402,
"volume_molar": 14.159831500338415,
"formula_full": "Ba1 Zn2 As2",
"formula_reduced": "Ba(ZnAs)2",
"formula_anonymous": "AB2C2",
"energy_above_hull": 0.126270054,
"spacegroup": 139
},
{
"id": "jvasp-65400",
"created_at": "2022-09-04T14:36:13.154847Z",
"updated_at": "2022-09-04T14:36:13.154870Z",
"structure_string": "Ba1 Zn1 Te2\n1.0\n3.346176 -4.311490 0.000000\n3.346176 4.311490 0.000000\n0.000000 0.000000 4.510741\nBa Zn Te\n1 1 2\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Zn\n0.000000 0.000000 0.000000 Te\n0.500001 0.500001 0.000000 Te\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Te"
],
"chemical_system": "Ba-Te-Zn",
"density": 5.842514968708791,
"density_atomic": 0.03073306972688789,
"volume": 130.15296016786965,
"volume_molar": 19.59498616153961,
"formula_full": "Ba1 Zn1 Te2",
"formula_reduced": "BaZnTe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2293144416666667,
"spacegroup": 65
},
{
"id": "jvasp-114591",
"created_at": "2022-09-04T14:38:41.390274Z",
"updated_at": "2022-09-04T14:38:41.390295Z",
"structure_string": "Ba1 Zn1 Te1\n1.0\n4.839946 -0.762896 0.000000\n-1.473697 6.374817 0.000000\n0.000000 0.000000 5.117389\nBa Zn Te\n1 1 1\ndirect\n-0.218516 -0.222951 0.000000 Ba\n0.105837 0.425648 0.000000 Zn\n0.478632 0.171340 0.000000 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Zn",
"Te"
],
"chemical_system": "Ba-Te-Zn",
"density": 3.605529691756553,
"density_atomic": 0.019719020021088458,
"volume": 152.13737786115422,
"volume_molar": 30.539756811239283,
"formula_full": "Ba1 Zn1 Te1",
"formula_reduced": "BaZnTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.1173566666666666,
"spacegroup": 38
}
]
}