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=83",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=density_atomic&page=81",
"results": [
{
"id": "jvasp-36493",
"created_at": "2022-09-04T14:37:13.341848Z",
"updated_at": "2022-09-04T14:37:13.341873Z",
"structure_string": "Ba3 Bi1 P1\n1.0\n6.100639 -0.000000 0.000000\n-0.000000 6.100639 -0.000000\n0.000000 -0.000000 6.100639\nBa Bi P\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ba\n0.500000 0.000000 0.500000 Ba\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.000000 Bi\n0.500000 0.500000 0.500000 P\n",
"nsites": 5,
"nelements": 3,
"elements": [
"Ba",
"Bi",
"P"
],
"chemical_system": "Ba-Bi-P",
"density": 4.767904219601084,
"density_atomic": 0.02202135428811115,
"volume": 227.05233904253524,
"volume_molar": 27.346822912027818,
"formula_full": "Ba3 Bi1 P1",
"formula_reduced": "Ba3BiP",
"formula_anonymous": "ABC3",
"energy_above_hull": 0.487161542,
"spacegroup": 221
},
{
"id": "jvasp-65729",
"created_at": "2022-09-04T14:36:22.456084Z",
"updated_at": "2022-09-04T14:36:22.456103Z",
"structure_string": "Ba1 Sr2 Tl1\n1.0\n4.181656 0.000000 0.000000\n0.000000 4.181656 -0.000000\n0.000000 -0.000000 10.386889\nBa Sr Tl\n1 2 1\ndirect\n0.500000 0.500000 0.691640 Ba\n0.000000 0.000000 0.013256 Sr\n0.500000 0.500000 0.311291 Sr\n0.000000 0.000000 0.483814 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Tl"
],
"chemical_system": "Ba-Sr-Tl",
"density": 4.726240227499286,
"density_atomic": 0.02202307179271277,
"volume": 181.6277056011579,
"volume_molar": 27.344690226150338,
"formula_full": "Ba1 Sr2 Tl1",
"formula_reduced": "BaSr2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
},
{
"id": "jvasp-69338",
"created_at": "2022-09-04T14:36:08.248076Z",
"updated_at": "2022-09-04T14:36:08.248099Z",
"structure_string": "Ba1 Sr2 Tl1\n1.0\n4.181619 0.000000 0.000000\n0.000000 4.181619 0.000000\n0.000000 0.000000 10.386796\nBa Sr Tl\n1 2 1\ndirect\n0.500000 0.500000 0.691640 Ba\n0.000000 0.000000 0.013270 Sr\n0.500000 0.500000 0.311247 Sr\n0.000000 0.000000 0.483843 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Tl"
],
"chemical_system": "Ba-Sr-Tl",
"density": 4.726366183725982,
"density_atomic": 0.022023658716544343,
"volume": 181.6228652778373,
"volume_molar": 27.343961498441317,
"formula_full": "Ba1 Sr2 Tl1",
"formula_reduced": "BaSr2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 3.0000000000002247e-05,
"spacegroup": 99
},
{
"id": "jvasp-69182",
"created_at": "2022-09-04T14:36:20.008233Z",
"updated_at": "2022-09-04T14:36:20.008249Z",
"structure_string": "Ba1 Sr2 Tl1\n1.0\n4.181276 0.000000 0.000000\n0.000000 4.181297 0.000000\n0.000000 0.000000 10.388438\nBa Sr Tl\n1 2 1\ndirect\n0.500001 0.500000 0.691640 Ba\n0.000000 0.000000 0.013293 Sr\n0.500001 0.500000 0.311249 Sr\n0.000000 0.000000 0.483817 Tl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Tl"
],
"chemical_system": "Ba-Sr-Tl",
"density": 4.72637073434071,
"density_atomic": 0.022023679921246188,
"volume": 181.62269040884536,
"volume_molar": 27.343935171299222,
"formula_full": "Ba1 Sr2 Tl1",
"formula_reduced": "BaSr2Tl",
"formula_anonymous": "ABC2",
"energy_above_hull": 4.250000000000087e-05,
"spacegroup": 99
},
{
"id": "jvasp-63965",
"created_at": "2022-09-04T14:37:40.544838Z",
"updated_at": "2022-09-04T14:37:40.544859Z",
"structure_string": "Ba1 Sn1 Br1\n1.0\n0.000000 4.083775 4.083775\n4.083775 -0.000000 4.083775\n4.083775 4.083775 -0.000000\nBa Sn Br\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.499999 0.499999 0.499999 Sn\n0.000000 0.000000 0.000000 Br\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Br"
],
"chemical_system": "Ba-Br-Sn",
"density": 4.095403470713369,
"density_atomic": 0.022024488983022155,
"volume": 136.21201392289223,
"volume_molar": 27.342930701557894,
"formula_full": "Ba1 Sn1 Br1",
"formula_reduced": "BaSnBr",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0281809674999999,
"spacegroup": 216
},
{
"id": "jvasp-64771",
"created_at": "2022-09-04T14:36:15.309188Z",
"updated_at": "2022-09-04T14:36:15.309218Z",
"structure_string": "Ba4 Na1 Sn1\n1.0\n-0.000000 5.144755 5.144755\n5.144755 0.000000 5.144755\n5.144755 5.144755 0.000000\nBa Na Sn\n4 1 1\ndirect\n0.119045 0.626985 0.626985 Ba\n0.626985 0.626985 0.626985 Ba\n0.626985 0.119045 0.626985 Ba\n0.626985 0.626985 0.119045 Ba\n0.250000 0.250000 0.250000 Na\n0.000000 0.000000 0.000000 Sn\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Sn"
],
"chemical_system": "Ba-Na-Sn",
"density": 4.213159865035252,
"density_atomic": 0.02203064239364177,
"volume": 272.34793669619233,
"volume_molar": 27.33529350800066,
"formula_full": "Ba4 Na1 Sn1",
"formula_reduced": "Ba4NaSn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0017986566666666,
"spacegroup": 216
},
{
"id": "jvasp-64870",
"created_at": "2022-09-04T14:38:13.048089Z",
"updated_at": "2022-09-04T14:38:13.048118Z",
"structure_string": "Ba4 Cd1 Cu1\n1.0\n-0.000000 5.144214 5.144214\n5.144214 -0.000000 5.144214\n5.144214 5.144214 0.000000\nBa Cd Cu\n4 1 1\ndirect\n0.125111 0.624963 0.624963 Ba\n0.624963 0.624963 0.624963 Ba\n0.624963 0.125111 0.624963 Ba\n0.624963 0.624963 0.125111 Ba\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Cu"
],
"chemical_system": "Ba-Cd-Cu",
"density": 4.423425736997913,
"density_atomic": 0.022037593794390076,
"volume": 272.2620289664913,
"volume_molar": 27.32667103399013,
"formula_full": "Ba4 Cd1 Cu1",
"formula_reduced": "Ba4CdCu",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-64776",
"created_at": "2022-09-04T14:36:17.303055Z",
"updated_at": "2022-09-04T14:36:17.303082Z",
"structure_string": "K1 Ba1 Hg1\n1.0\n0.000000 4.082941 4.082941\n4.082941 -0.000000 4.082941\n4.082941 4.082941 0.000000\nK Ba Hg\n1 1 1\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Hg\n",
"nsites": 3,
"nelements": 3,
"elements": [
"K",
"Ba",
"Hg"
],
"chemical_system": "Ba-Hg-K",
"density": 4.598950806634185,
"density_atomic": 0.022037988205336163,
"volume": 136.1285781645711,
"volume_molar": 27.326181972190323,
"formula_full": "K1 Ba1 Hg1",
"formula_reduced": "KBaHg",
"formula_anonymous": "ABC",
"energy_above_hull": 0.0082439949999998,
"spacegroup": 216
},
{
"id": "jvasp-64777",
"created_at": "2022-09-04T14:36:19.088861Z",
"updated_at": "2022-09-04T14:36:19.088890Z",
"structure_string": "Ba4 La1 Ga1\n1.0\n0.000000 5.143648 5.143648\n5.143648 0.000000 5.143648\n5.143648 5.143648 -0.000000\nBa La Ga\n4 1 1\ndirect\n0.128025 0.623992 0.623992 Ba\n0.623992 0.623992 0.623992 Ba\n0.623992 0.128025 0.623992 Ba\n0.623992 0.623992 0.128025 Ba\n0.000000 0.000000 0.000000 La\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"La",
"Ga"
],
"chemical_system": "Ba-Ga-La",
"density": 4.624216778362432,
"density_atomic": 0.02204486955510336,
"volume": 272.1721707176538,
"volume_molar": 27.317652050274354,
"formula_full": "Ba4 La1 Ga1",
"formula_reduced": "Ba4LaGa",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.1615002008333332,
"spacegroup": 216
},
{
"id": "jvasp-64332",
"created_at": "2022-09-04T14:35:53.314307Z",
"updated_at": "2022-09-04T14:35:53.314332Z",
"structure_string": "Ba4 La1 Zr1\n1.0\n0.000000 5.143498 5.143498\n5.143498 0.000000 5.143498\n5.143498 5.143498 0.000000\nBa La Zr\n4 1 1\ndirect\n0.117919 0.627360 0.627360 Ba\n0.627360 0.627360 0.627360 Ba\n0.627360 0.117919 0.627360 Ba\n0.627360 0.627360 0.117919 Ba\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Zr\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"La",
"Zr"
],
"chemical_system": "Ba-La-Zr",
"density": 4.7558117523294055,
"density_atomic": 0.022046798297100625,
"volume": 272.1483600087665,
"volume_molar": 27.31526219293244,
"formula_full": "Ba4 La1 Zr1",
"formula_reduced": "Ba4LaZr",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.0869655633333333,
"spacegroup": 216
},
{
"id": "jvasp-117498",
"created_at": "2022-09-04T14:38:45.472216Z",
"updated_at": "2022-09-04T14:38:45.472243Z",
"structure_string": "B1 I2\n1.0\n4.225564 0.000000 0.000000\n0.000000 4.222404 0.000000\n0.000000 0.000000 7.625163\nB I\n1 2\ndirect\n0.293293 0.000000 0.000000 B\n0.053354 0.000000 0.756554 I\n0.053354 0.000000 0.243445 I\n",
"nsites": 3,
"nelements": 2,
"elements": [
"B",
"I"
],
"chemical_system": "B-I",
"density": 3.2298181004816544,
"density_atomic": 0.022050967780830877,
"volume": 136.04845056315077,
"volume_molar": 27.310097315706507,
"formula_full": "B1 I2",
"formula_reduced": "BI2",
"formula_anonymous": "AB2",
"energy_above_hull": 1.4170450444444445,
"spacegroup": 25
},
{
"id": "jvasp-64352",
"created_at": "2022-09-04T14:36:11.057759Z",
"updated_at": "2022-09-04T14:36:11.057785Z",
"structure_string": "Ba4 Mg1 Tl1\n1.0\n0.000000 5.141281 5.141281\n5.141281 -0.000000 5.141281\n5.141281 5.141281 0.000000\nBa Mg Tl\n4 1 1\ndirect\n0.123237 0.625587 0.625587 Ba\n0.625587 0.625587 0.625587 Ba\n0.625587 0.123237 0.625587 Ba\n0.625587 0.625587 0.123237 Ba\n0.250000 0.250000 0.250000 Mg\n0.000000 0.000000 0.000000 Tl\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Mg",
"Tl"
],
"chemical_system": "Ba-Mg-Tl",
"density": 4.7531619286274776,
"density_atomic": 0.0220753313601823,
"volume": 271.7965996570414,
"volume_molar": 27.27995635373452,
"formula_full": "Ba4 Mg1 Tl1",
"formula_reduced": "Ba4MgTl",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
}
]
}