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=3562",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=id&page=3560",
"results": [
{
"id": "jvasp-68975",
"created_at": "2022-09-04T14:36:04.862495Z",
"updated_at": "2022-09-04T14:36:04.862531Z",
"structure_string": "Ba1 Cd1 Ir2\n1.0\n4.471238 0.000000 0.000000\n0.000000 4.471238 0.000000\n0.000000 0.000000 4.285737\nBa Cd Ir\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.500000 Cd\n0.500000 0.000000 0.000000 Ir\n0.000000 0.500000 0.000000 Ir\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Cd",
"Ir"
],
"chemical_system": "Ba-Cd-Ir",
"density": 12.290656154411138,
"density_atomic": 0.046685165172983066,
"volume": 85.68032232891873,
"volume_molar": 12.89947403567299,
"formula_full": "Ba1 Cd1 Ir2",
"formula_reduced": "BaCdIr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.88894948,
"spacegroup": 123
},
{
"id": "jvasp-68976",
"created_at": "2022-09-04T14:36:09.122253Z",
"updated_at": "2022-09-04T14:36:09.122280Z",
"structure_string": "Ba1 V2 Bi1\n1.0\n3.641661 0.000000 0.000000\n0.000000 4.337167 0.000000\n0.000000 0.000000 7.150318\nBa V Bi\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.870583 V\n0.000000 0.000000 0.129417 V\n0.500000 0.500000 0.000000 Bi\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"V",
"Bi"
],
"chemical_system": "Ba-Bi-V",
"density": 6.5899274095748614,
"density_atomic": 0.03541840295763268,
"volume": 112.93563983629583,
"volume_molar": 17.002857997870922,
"formula_full": "Ba1 V2 Bi1",
"formula_reduced": "BaV2Bi",
"formula_anonymous": "ABC2",
"energy_above_hull": 2.4514421675,
"spacegroup": 47
},
{
"id": "jvasp-68978",
"created_at": "2022-09-04T14:36:09.776328Z",
"updated_at": "2022-09-04T14:36:09.776360Z",
"structure_string": "Ba2 Zr1 Cl1\n1.0\n0.000000 4.228027 4.228027\n4.228027 0.000000 4.228027\n4.228027 4.228027 0.000000\nBa Zr Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750001 0.750001 0.750001 Ba\n0.500000 0.500000 0.500000 Zr\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Zr",
"Cl"
],
"chemical_system": "Ba-Cl-Zr",
"density": 4.4086797546801915,
"density_atomic": 0.026461638954001946,
"volume": 151.1622166319013,
"volume_molar": 22.75800365377307,
"formula_full": "Ba2 Zr1 Cl1",
"formula_reduced": "Ba2ZrCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.977777626875,
"spacegroup": 225
},
{
"id": "jvasp-68980",
"created_at": "2022-09-04T14:36:10.725559Z",
"updated_at": "2022-09-04T14:36:10.725587Z",
"structure_string": "Ba1 Re1 Br2\n1.0\n4.268643 0.000000 0.000000\n0.000000 4.268643 0.000000\n0.000000 0.000000 6.778327\nBa Re Br\n1 1 2\ndirect\n0.500000 0.500000 0.776183 Ba\n0.000000 0.000000 0.444305 Re\n0.000000 0.000000 0.984480 Br\n0.500000 0.500000 0.295032 Br\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Re",
"Br"
],
"chemical_system": "Ba-Br-Re",
"density": 6.498325274148277,
"density_atomic": 0.032386036817582856,
"volume": 123.51001829987241,
"volume_molar": 18.59486788680019,
"formula_full": "Ba1 Re1 Br2",
"formula_reduced": "BaReBr2",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.670718045,
"spacegroup": 99
},
{
"id": "jvasp-68981",
"created_at": "2022-09-04T14:36:11.564316Z",
"updated_at": "2022-09-04T14:36:11.564329Z",
"structure_string": "Ba1 Re1 Se4\n1.0\n0.000000 4.252977 4.252977\n4.252977 0.000000 4.252977\n4.252977 4.252977 -0.000000\nBa Re Se\n1 1 4\ndirect\n0.250000 0.250000 0.250000 Ba\n0.000000 0.000000 0.000000 Re\n0.121721 0.626094 0.626094 Se\n0.626094 0.626094 0.626094 Se\n0.626094 0.121721 0.626094 Se\n0.626094 0.626094 0.121721 Se\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Re",
"Se"
],
"chemical_system": "Ba-Re-Se",
"density": 6.900728983163892,
"density_atomic": 0.03899798361921431,
"volume": 153.85410842225696,
"volume_molar": 15.442184957052216,
"formula_full": "Ba1 Re1 Se4",
"formula_reduced": "BaReSe4",
"formula_anonymous": "ABC4",
"energy_above_hull": 2.3641762394444443,
"spacegroup": 216
},
{
"id": "jvasp-68982",
"created_at": "2022-09-04T14:36:14.636591Z",
"updated_at": "2022-09-04T14:36:14.636622Z",
"structure_string": "Ba1 Na2 Pt1\n1.0\n4.228068 0.000000 -0.000000\n0.000000 4.228068 0.000000\n-0.000000 0.000000 6.489773\nBa Na Pt\n1 2 1\ndirect\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.810771 Na\n0.000000 0.000000 0.189229 Na\n0.500000 0.500000 0.000000 Pt\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Na",
"Pt"
],
"chemical_system": "Ba-Na-Pt",
"density": 5.415966044680867,
"density_atomic": 0.034478356681794435,
"volume": 116.01481001303391,
"volume_molar": 17.466437903578694,
"formula_full": "Ba1 Na2 Pt1",
"formula_reduced": "BaNa2Pt",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.2268663425,
"spacegroup": 123
},
{
"id": "jvasp-68984",
"created_at": "2022-09-04T14:36:17.309667Z",
"updated_at": "2022-09-04T14:36:17.309693Z",
"structure_string": "Ba2 Hf1 Cl1\n1.0\n0.000000 4.191979 4.191979\n4.191979 0.000000 4.191979\n4.191979 4.191979 -0.000000\nBa Hf Cl\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Hf\n0.000000 0.000000 0.000000 Cl\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Hf",
"Cl"
],
"chemical_system": "Ba-Cl-Hf",
"density": 5.506968633031853,
"density_atomic": 0.027150179211483726,
"volume": 147.328677606228,
"volume_molar": 22.180850863234124,
"formula_full": "Ba2 Hf1 Cl1",
"formula_reduced": "Ba2HfCl",
"formula_anonymous": "ABC2",
"energy_above_hull": 1.297187251875,
"spacegroup": 225
},
{
"id": "jvasp-68986",
"created_at": "2022-09-04T14:36:19.244469Z",
"updated_at": "2022-09-04T14:36:19.244487Z",
"structure_string": "K1 Ba2 Pd1\n1.0\n-0.000000 4.194104 4.194104\n4.194104 -0.000000 4.194104\n4.194104 4.194104 0.000000\nK Ba Pd\n1 2 1\ndirect\n0.000000 0.000000 0.000000 K\n0.250000 0.250000 0.250000 Ba\n0.749999 0.749999 0.749999 Ba\n0.500000 0.500000 0.500000 Pd\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Pd"
],
"chemical_system": "Ba-K-Pd",
"density": 4.728560323169487,
"density_atomic": 0.027108932091066885,
"volume": 147.5528429730401,
"volume_molar": 22.21459974804561,
"formula_full": "K1 Ba2 Pd1",
"formula_reduced": "KBa2Pd",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.05310891,
"spacegroup": 225
},
{
"id": "jvasp-68987",
"created_at": "2022-09-04T14:36:20.274584Z",
"updated_at": "2022-09-04T14:36:20.274608Z",
"structure_string": "Ba1 Sr2 Mg1\n1.0\n4.167179 0.000000 0.000000\n-0.000000 4.167059 0.000000\n0.000000 0.000000 10.675929\nBa Sr Mg\n1 2 1\ndirect\n0.500000 0.500000 0.000000 Ba\n0.000000 0.000000 0.693964 Sr\n0.000000 0.000000 0.306036 Sr\n0.500000 0.500000 0.500000 Mg\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Sr",
"Mg"
],
"chemical_system": "Ba-Mg-Sr",
"density": 3.0174253191380997,
"density_atomic": 0.021576575091924757,
"volume": 185.38623405051152,
"volume_molar": 27.910549910462137,
"formula_full": "Ba1 Sr2 Mg1",
"formula_reduced": "BaSr2Mg",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 123
},
{
"id": "jvasp-68988",
"created_at": "2022-09-04T14:36:20.990443Z",
"updated_at": "2022-09-04T14:36:20.990470Z",
"structure_string": "K2 Ba1 Zn1\n1.0\n4.230873 -0.000000 0.000000\n0.000000 4.230873 -0.000000\n0.000000 -0.000000 11.015405\nK Ba Zn\n2 1 1\ndirect\n0.000000 0.000000 0.989761 K\n0.500000 0.500000 0.318494 K\n0.500000 0.500000 0.671746 Ba\n0.000000 0.000000 0.520000 Zn\n",
"nsites": 4,
"nelements": 3,
"elements": [
"K",
"Ba",
"Zn"
],
"chemical_system": "Ba-K-Zn",
"density": 2.36586951589687,
"density_atomic": 0.020286145857686403,
"volume": 197.1789036745195,
"volume_molar": 29.685977820760936,
"formula_full": "K2 Ba1 Zn1",
"formula_reduced": "K2BaZn",
"formula_anonymous": "ABC2",
"energy_above_hull": 5.000000000032756e-06,
"spacegroup": 99
},
{
"id": "jvasp-68990",
"created_at": "2022-09-04T14:36:21.899467Z",
"updated_at": "2022-09-04T14:36:21.899496Z",
"structure_string": "Ba1 Y1 Ge2\n1.0\n4.434306 -0.000000 0.000000\n0.000000 4.434306 0.000000\n-0.000000 0.000000 6.266833\nBa Y Ge\n1 1 2\ndirect\n0.500000 0.500000 0.874985 Ba\n0.000000 0.000000 0.375026 Y\n0.000000 0.000000 0.875010 Ge\n0.500000 0.500000 0.374978 Ge\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Y",
"Ge"
],
"chemical_system": "Ba-Ge-Y",
"density": 5.0063763815889155,
"density_atomic": 0.032460899565532456,
"volume": 123.22517408751264,
"volume_molar": 18.551983588262644,
"formula_full": "Ba1 Y1 Ge2",
"formula_reduced": "BaYGe2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.98997833,
"spacegroup": 123
},
{
"id": "jvasp-68991",
"created_at": "2022-09-04T14:36:22.368373Z",
"updated_at": "2022-09-04T14:36:22.368399Z",
"structure_string": "Ba1 Tl1 Pb2\n1.0\n4.247271 -0.000000 -0.000000\n0.000000 4.247271 -0.000000\n0.000000 0.000000 7.612390\nBa Tl Pb\n1 1 2\ndirect\n0.500000 0.500000 0.747874 Ba\n0.000000 0.000000 0.462678 Tl\n0.000000 0.000000 0.044850 Pb\n0.500000 0.500000 0.244598 Pb\n",
"nsites": 4,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Pb"
],
"chemical_system": "Ba-Pb-Tl",
"density": 9.143095940682242,
"density_atomic": 0.029128560082305976,
"volume": 137.32227026319038,
"volume_molar": 20.674351025192365,
"formula_full": "Ba1 Tl1 Pb2",
"formula_reduced": "BaTlPb2",
"formula_anonymous": "ABC2",
"energy_above_hull": 0.0,
"spacegroup": 99
}
]
}