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=-chemical_system&page=3834",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-chemical_system&page=3832",
"results": [
{
"id": "jvasp-66029",
"created_at": "2022-09-04T14:35:43.171810Z",
"updated_at": "2022-09-04T14:35:43.171838Z",
"structure_string": "Ba4 Ge1 W1\n1.0\n-0.000000 4.853401 4.853401\n4.853401 0.000000 4.853401\n4.853401 4.853401 0.000000\nBa Ge W\n4 1 1\ndirect\n0.126013 0.624662 0.624662 Ba\n0.624662 0.624662 0.624662 Ba\n0.624662 0.126013 0.624662 Ba\n0.624662 0.624662 0.126013 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 W\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"W"
],
"chemical_system": "Ba-Ge-W",
"density": 5.851960303273062,
"density_atomic": 0.026241141849038196,
"volume": 228.64858680758647,
"volume_molar": 22.94923290550608,
"formula_full": "Ba4 Ge1 W1",
"formula_reduced": "Ba4GeW",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.626838305,
"spacegroup": 216
},
{
"id": "jvasp-63984",
"created_at": "2022-09-04T14:36:04.391095Z",
"updated_at": "2022-09-04T14:36:04.391121Z",
"structure_string": "Ba4 V1 Ge1\n1.0\n-0.000000 4.881558 4.881558\n4.881558 0.000000 4.881558\n4.881558 4.881558 0.000000\nBa V Ge\n4 1 1\ndirect\n0.126570 0.624477 0.624477 Ba\n0.624477 0.624477 0.624477 Ba\n0.624477 0.126570 0.624477 Ba\n0.624477 0.624477 0.126570 Ba\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"V",
"Ge"
],
"chemical_system": "Ba-Ge-V",
"density": 4.802722479514651,
"density_atomic": 0.02578967644421425,
"volume": 232.6512320919816,
"volume_molar": 23.350974460755705,
"formula_full": "Ba4 V1 Ge1",
"formula_reduced": "Ba4VGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.9475906716666666,
"spacegroup": 216
},
{
"id": "jvasp-64866",
"created_at": "2022-09-04T14:35:50.759924Z",
"updated_at": "2022-09-04T14:35:50.759956Z",
"structure_string": "Ba4 Tl1 Ge1\n1.0\n-0.000000 4.980828 4.980828\n4.980828 -0.000000 4.980828\n4.980828 4.980828 -0.000000\nBa Tl Ge\n4 1 1\ndirect\n0.127321 0.624227 0.624227 Ba\n0.624227 0.624227 0.624227 Ba\n0.624227 0.127321 0.624227 Ba\n0.624227 0.624227 0.127321 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Ge"
],
"chemical_system": "Ba-Ge-Tl",
"density": 5.552245629627253,
"density_atomic": 0.02427820758618127,
"volume": 247.13521287358523,
"volume_molar": 24.80471731128824,
"formula_full": "Ba4 Tl1 Ge1",
"formula_reduced": "Ba4TlGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-63899",
"created_at": "2022-09-04T14:36:12.600262Z",
"updated_at": "2022-09-04T14:36:12.600290Z",
"structure_string": "Ba4 Ge1 Te1\n1.0\n0.000000 4.910973 4.910973\n4.910973 -0.000000 4.910973\n4.910973 4.910973 0.000000\nBa Ge Te\n4 1 1\ndirect\n0.124664 0.625112 0.625112 Ba\n0.625112 0.625112 0.625112 Ba\n0.625112 0.124664 0.625112 Ba\n0.625112 0.625112 0.124664 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Te\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Te"
],
"chemical_system": "Ba-Ge-Te",
"density": 5.254312661137847,
"density_atomic": 0.02532903332677067,
"volume": 236.8823129802787,
"volume_molar": 23.77564387202689,
"formula_full": "Ba4 Ge1 Te1",
"formula_reduced": "Ba4GeTe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.134276266111111,
"spacegroup": 216
},
{
"id": "jvasp-66123",
"created_at": "2022-09-04T14:36:17.838298Z",
"updated_at": "2022-09-04T14:36:17.838335Z",
"structure_string": "Ba1 Ge1 Te1\n1.0\n0.000000 3.910084 3.910084\n3.910084 0.000000 3.910084\n3.910084 3.910084 0.000000\nBa Ge Te\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.000000 0.000000 0.000000 Ge\n0.499999 0.499999 0.499999 Te\n",
"nsites": 3,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Te"
],
"chemical_system": "Ba-Ge-Te",
"density": 4.688358614937499,
"density_atomic": 0.02509186815263575,
"volume": 119.56064736793493,
"volume_molar": 24.000368260214255,
"formula_full": "Ba1 Ge1 Te1",
"formula_reduced": "BaGeTe",
"formula_anonymous": "ABC",
"energy_above_hull": 0.3507865622222222,
"spacegroup": 216
},
{
"id": "jvasp-66050",
"created_at": "2022-09-04T14:36:01.619381Z",
"updated_at": "2022-09-04T14:36:01.619400Z",
"structure_string": "Ba4 Tc1 Ge1\n1.0\n-0.000000 4.767028 4.767028\n4.767028 -0.000000 4.767028\n4.767028 4.767028 0.000000\nBa Tc Ge\n4 1 1\ndirect\n0.124608 0.625131 0.625131 Ba\n0.625131 0.625131 0.625131 Ba\n0.625131 0.124608 0.625131 Ba\n0.625131 0.625131 0.124608 Ba\n0.000000 0.000000 0.000000 Tc\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tc",
"Ge"
],
"chemical_system": "Ba-Ge-Tc",
"density": 5.51794189372894,
"density_atomic": 0.027693519088339842,
"volume": 216.65718902897598,
"volume_molar": 21.745668149973685,
"formula_full": "Ba4 Tc1 Ge1",
"formula_reduced": "Ba4TcGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.1577768883333333,
"spacegroup": 216
},
{
"id": "jvasp-66576",
"created_at": "2022-09-04T14:35:51.985189Z",
"updated_at": "2022-09-04T14:35:51.985207Z",
"structure_string": "Ba4 Ta1 Ge1\n1.0\n0.000000 4.877587 4.877587\n4.877587 -0.000000 4.877587\n4.877587 4.877587 -0.000000\nBa Ta Ge\n4 1 1\ndirect\n0.125990 0.624670 0.624670 Ba\n0.624670 0.624670 0.624670 Ba\n0.624670 0.125990 0.624670 Ba\n0.624670 0.624670 0.125990 Ba\n0.000000 0.000000 0.000000 Ta\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ta",
"Ge"
],
"chemical_system": "Ba-Ge-Ta",
"density": 5.744645816718798,
"density_atomic": 0.02585271634716652,
"volume": 232.08392957352063,
"volume_molar": 23.294034867094467,
"formula_full": "Ba4 Ta1 Ge1",
"formula_reduced": "Ba4TaGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 1.3794831716666662,
"spacegroup": 216
},
{
"id": "jvasp-63904",
"created_at": "2022-09-04T14:36:17.515609Z",
"updated_at": "2022-09-04T14:36:17.515636Z",
"structure_string": "Ba4 Sn1 Ge1\n1.0\n-0.000000 4.932068 4.932068\n4.932068 -0.000000 4.932068\n4.932068 4.932068 0.000000\nBa Sn Ge\n4 1 1\ndirect\n0.125217 0.624928 0.624928 Ba\n0.624928 0.624928 0.624928 Ba\n0.624928 0.125217 0.624928 Ba\n0.624928 0.624928 0.125217 Ba\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Sn",
"Ge"
],
"chemical_system": "Ba-Ge-Sn",
"density": 5.125658323542667,
"density_atomic": 0.02500541620238222,
"volume": 239.94801571942605,
"volume_molar": 24.083345429084602,
"formula_full": "Ba4 Sn1 Ge1",
"formula_reduced": "Ba4SnGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0842369216666666,
"spacegroup": 216
},
{
"id": "jvasp-66305",
"created_at": "2022-09-04T14:36:04.967681Z",
"updated_at": "2022-09-04T14:36:04.967719Z",
"structure_string": "Ba4 Si1 Ge1\n1.0\n-0.000000 4.864083 4.864083\n4.864083 -0.000000 4.864083\n4.864083 4.864083 0.000000\nBa Si Ge\n4 1 1\ndirect\n0.124676 0.625108 0.625108 Ba\n0.625108 0.625108 0.625108 Ba\n0.625108 0.124676 0.625108 Ba\n0.625108 0.625108 0.124676 Ba\n0.000000 0.000000 0.000000 Si\n0.250000 0.250000 0.250000 Ge\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Si",
"Ge"
],
"chemical_system": "Ba-Ge-Si",
"density": 4.6897739454961975,
"density_atomic": 0.02606863693220611,
"volume": 230.16163122005773,
"volume_molar": 23.101095679306635,
"formula_full": "Ba4 Si1 Ge1",
"formula_reduced": "Ba4SiGe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6304147383333333,
"spacegroup": 216
},
{
"id": "jvasp-85234",
"created_at": "2022-09-04T14:37:19.209742Z",
"updated_at": "2022-09-04T14:37:19.209753Z",
"structure_string": "Ba4 Ge2 Te4 Se4\n1.0\n7.242291 0.000000 0.000000\n0.000000 7.153801 -2.328902\n0.000000 -0.013177 9.304047\nBa Ge Te Se\n4 2 4 4\ndirect\n0.250000 0.225182 0.054753 Ba\n0.250000 0.224171 0.557403 Ba\n0.750000 0.775828 0.442598 Ba\n0.750000 0.774818 0.945247 Ba\n0.250000 0.783345 0.696350 Ge\n0.750000 0.216654 0.303650 Ge\n0.250000 0.609609 0.900643 Te\n0.250000 0.610495 0.405418 Te\n0.750000 0.389505 0.594583 Te\n0.750000 0.390390 0.099357 Te\n0.505260 -0.004064 0.751273 Se\n0.005260 0.004064 0.248727 Se\n0.494740 0.004064 0.248727 Se\n0.994740 -0.004064 0.751273 Se\n",
"nsites": 14,
"nelements": 4,
"elements": [
"Ba",
"Ge",
"Te",
"Se"
],
"chemical_system": "Ba-Ge-Se-Te",
"density": 5.241369271079173,
"density_atomic": 0.029056519837272487,
"volume": 481.8195736586935,
"volume_molar": 20.725609239256006,
"formula_full": "Ba4 Ge2 Te4 Se4",
"formula_reduced": "Ba2Ge(TeSe)2",
"formula_anonymous": "AB2C2D2",
"energy_above_hull": 0.6189500223809523,
"spacegroup": 11
},
{
"id": "jvasp-10877",
"created_at": "2022-09-04T14:37:15.808762Z",
"updated_at": "2022-09-04T14:37:15.808786Z",
"structure_string": "Ba4 Ge2 Se8\n1.0\n0.000000 7.097853 0.045375\n7.112894 0.000000 0.000000\n0.000000 -2.947405 -8.719041\nBa Ge Se\n4 2 8\ndirect\n0.717434 0.250000 0.924262 Ba\n0.282566 0.750000 0.075738 Ba\n0.782579 0.250000 0.451370 Ba\n0.217421 0.750000 0.548630 Ba\n0.792480 0.750000 0.709905 Ge\n0.207520 0.250000 0.290095 Ge\n0.011619 0.011098 0.771903 Se\n0.988381 0.511097 0.228097 Se\n0.988381 0.988902 0.228097 Se\n0.011619 0.488902 0.771903 Se\n0.627913 0.750000 0.437158 Se\n0.372087 0.250000 0.562841 Se\n0.588869 0.750000 0.871765 Se\n0.411131 0.250000 0.128235 Se\n",
"nsites": 14,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Se"
],
"chemical_system": "Ba-Ge-Se",
"density": 5.013925426052604,
"density_atomic": 0.031873188948819464,
"volume": 439.2406427383395,
"volume_molar": 18.894064129165375,
"formula_full": "Ba4 Ge2 Se8",
"formula_reduced": "Ba2GeSe4",
"formula_anonymous": "AB2C4",
"energy_above_hull": 0.7549644795238095,
"spacegroup": 11
},
{
"id": "jvasp-66681",
"created_at": "2022-09-04T14:35:52.293250Z",
"updated_at": "2022-09-04T14:35:52.293277Z",
"structure_string": "Ba4 Ge1 Se1\n1.0\n-0.000000 4.847003 4.847003\n4.847003 0.000000 4.847003\n4.847003 4.847003 -0.000000\nBa Ge Se\n4 1 1\ndirect\n0.124175 0.625274 0.625274 Ba\n0.625274 0.625274 0.625274 Ba\n0.625274 0.124175 0.625274 Ba\n0.625274 0.625274 0.124175 Ba\n0.250000 0.250000 0.250000 Ge\n0.000000 0.000000 0.000000 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Ge",
"Se"
],
"chemical_system": "Ba-Ge-Se",
"density": 5.110463057099041,
"density_atomic": 0.026345193282940858,
"volume": 227.74552972762373,
"volume_molar": 22.858593958008576,
"formula_full": "Ba4 Ge1 Se1",
"formula_reduced": "Ba4GeSe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.233388866111111,
"spacegroup": 216
}
]
}