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=4176",
"previous": "https://simmate.org/third-parties/JarvisStructure/?format=api&ordering=-structure_string&page=4174",
"results": [
{
"id": "jvasp-66188",
"created_at": "2022-09-04T14:36:18.953480Z",
"updated_at": "2022-09-04T14:36:18.953502Z",
"structure_string": "Ba4 Tl1 Ir1\n1.0\n-0.000000 4.800811 4.800811\n4.800811 0.000000 4.800811\n4.800811 4.800811 0.000000\nBa Tl Ir\n4 1 1\ndirect\n0.127749 0.624084 0.624084 Ba\n0.624084 0.624084 0.624084 Ba\n0.624084 0.127749 0.624084 Ba\n0.624084 0.624084 0.127749 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Ir\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Ir"
],
"chemical_system": "Ba-Ir-Tl",
"density": 7.097809050399105,
"density_atomic": 0.027112990891745063,
"volume": 221.29613158343167,
"volume_molar": 22.211274233981786,
"formula_full": "Ba4 Tl1 Ir1",
"formula_reduced": "Ba4TlIr",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.6719445966666665,
"spacegroup": 216
},
{
"id": "jvasp-64490",
"created_at": "2022-09-04T14:36:10.688346Z",
"updated_at": "2022-09-04T14:36:10.688380Z",
"structure_string": "Ba4 Tl1 In1\n1.0\n-0.000000 5.069472 5.069472\n5.069472 0.000000 5.069472\n5.069472 5.069472 -0.000000\nBa Tl In\n4 1 1\ndirect\n0.125352 0.624883 0.624883 Ba\n0.624883 0.624883 0.624883 Ba\n0.624883 0.125352 0.624883 Ba\n0.624883 0.624883 0.125352 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 In\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"In"
],
"chemical_system": "Ba-In-Tl",
"density": 5.534844054038308,
"density_atomic": 0.023026772417695306,
"volume": 260.5662613571149,
"volume_molar": 26.152778386658245,
"formula_full": "Ba4 Tl1 In1",
"formula_reduced": "Ba4TlIn",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-64197",
"created_at": "2022-09-04T14:38:14.253414Z",
"updated_at": "2022-09-04T14:38:14.253438Z",
"structure_string": "Ba4 Tl1 Hg1\n1.0\n0.000000 5.055373 5.055373\n5.055373 0.000000 5.055373\n5.055373 5.055373 0.000000\nBa Tl Hg\n4 1 1\ndirect\n0.124320 0.625226 0.625226 Ba\n0.625226 0.625226 0.625226 Ba\n0.625226 0.124320 0.625226 Ba\n0.625226 0.625226 0.124320 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Hg\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Hg"
],
"chemical_system": "Ba-Hg-Tl",
"density": 6.132476625025957,
"density_atomic": 0.023219969283320437,
"volume": 258.3982746398364,
"volume_molar": 25.93517970037055,
"formula_full": "Ba4 Tl1 Hg1",
"formula_reduced": "Ba4TlHg",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"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-64835",
"created_at": "2022-09-04T14:36:11.067716Z",
"updated_at": "2022-09-04T14:36:11.067739Z",
"structure_string": "Ba4 Tl1 Ga1\n1.0\n0.000000 5.038496 5.038496\n5.038496 0.000000 5.038496\n5.038496 5.038496 0.000000\nBa Tl Ga\n4 1 1\ndirect\n0.125319 0.624894 0.624894 Ba\n0.624894 0.624894 0.624894 Ba\n0.624894 0.125319 0.624894 Ba\n0.624894 0.624894 0.125319 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Ga\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Ga"
],
"chemical_system": "Ba-Ga-Tl",
"density": 5.3448405352546935,
"density_atomic": 0.023454085303726776,
"volume": 255.81897235815973,
"volume_molar": 25.676297676989783,
"formula_full": "Ba4 Tl1 Ga1",
"formula_reduced": "Ba4TlGa",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-66092",
"created_at": "2022-09-04T14:35:41.959629Z",
"updated_at": "2022-09-04T14:35:41.959664Z",
"structure_string": "Ba4 Tl1 Fe1\n1.0\n0.000000 4.943876 4.943876\n4.943876 -0.000000 4.943876\n4.943876 4.943876 0.000000\nBa Tl Fe\n4 1 1\ndirect\n0.125738 0.624754 0.624754 Ba\n0.624754 0.624754 0.624754 Ba\n0.624754 0.125738 0.624754 Ba\n0.624754 0.624754 0.125738 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Fe\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Fe"
],
"chemical_system": "Ba-Fe-Tl",
"density": 5.562278385064639,
"density_atomic": 0.024826674277168687,
"volume": 241.67554353092592,
"volume_molar": 24.256735689879058,
"formula_full": "Ba4 Tl1 Fe1",
"formula_reduced": "Ba4TlFe",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.4945003299999999,
"spacegroup": 216
},
{
"id": "jvasp-64262",
"created_at": "2022-09-04T14:35:51.931977Z",
"updated_at": "2022-09-04T14:35:51.932004Z",
"structure_string": "Ba4 Tl1 Cu1\n1.0\n-0.000000 5.095941 5.095941\n5.095941 0.000000 5.095941\n5.095941 5.095941 -0.000000\nBa Tl Cu\n4 1 1\ndirect\n0.124424 0.625192 0.625192 Ba\n0.625192 0.625192 0.625192 Ba\n0.625192 0.124424 0.625192 Ba\n0.625192 0.625192 0.124424 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Cu\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Cu"
],
"chemical_system": "Ba-Cu-Tl",
"density": 5.127363513520181,
"density_atomic": 0.022669820491632506,
"volume": 264.66905647597065,
"volume_molar": 26.564571881911412,
"formula_full": "Ba4 Tl1 Cu1",
"formula_reduced": "Ba4TlCu",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-64837",
"created_at": "2022-09-04T14:36:11.857117Z",
"updated_at": "2022-09-04T14:36:11.857135Z",
"structure_string": "Ba4 Tl1 Co1\n1.0\n-0.000000 4.968351 4.968351\n4.968351 -0.000000 4.968351\n4.968351 4.968351 -0.000000\nBa Tl Co\n4 1 1\ndirect\n0.124972 0.625009 0.625009 Ba\n0.625009 0.625009 0.625009 Ba\n0.625009 0.124972 0.625009 Ba\n0.625009 0.625009 0.124972 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Co\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Co"
],
"chemical_system": "Ba-Co-Tl",
"density": 5.501387054449081,
"density_atomic": 0.024461576606978765,
"volume": 245.28263637300591,
"volume_molar": 24.618776037035623,
"formula_full": "Ba4 Tl1 Co1",
"formula_reduced": "Ba4TlCo",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.4340995633333333,
"spacegroup": 216
},
{
"id": "jvasp-64725",
"created_at": "2022-09-04T14:35:50.736100Z",
"updated_at": "2022-09-04T14:35:50.736129Z",
"structure_string": "Ba4 Tl1 Cd1\n1.0\n-0.000000 5.083711 5.083711\n5.083711 -0.000000 5.083711\n5.083711 5.083711 0.000000\nBa Tl Cd\n4 1 1\ndirect\n0.124023 0.625326 0.625326 Ba\n0.625326 0.625326 0.625326 Ba\n0.625326 0.124023 0.625326 Ba\n0.625326 0.625326 0.124023 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Cd\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Cd"
],
"chemical_system": "Ba-Cd-Tl",
"density": 5.473255631407681,
"density_atomic": 0.022833826331501664,
"volume": 262.76804916057233,
"volume_molar": 26.373769654592778,
"formula_full": "Ba4 Tl1 Cd1",
"formula_reduced": "Ba4TlCd",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-64676",
"created_at": "2022-09-04T14:38:08.359350Z",
"updated_at": "2022-09-04T14:38:08.359366Z",
"structure_string": "Ba4 Tl1 Bi1\n1.0\n0.000000 5.046004 5.046004\n5.046004 0.000000 5.046004\n5.046004 5.046004 0.000000\nBa Tl Bi\n4 1 1\ndirect\n0.127874 0.624042 0.624042 Ba\n0.624042 0.624042 0.624042 Ba\n0.624042 0.127874 0.624042 Ba\n0.624042 0.624042 0.127874 Ba\n0.000000 0.000000 0.000000 Tl\n0.250000 0.250000 0.250000 Bi\n",
"nsites": 6,
"nelements": 3,
"elements": [
"Ba",
"Tl",
"Bi"
],
"chemical_system": "Ba-Bi-Tl",
"density": 6.220918838631618,
"density_atomic": 0.023349548292977862,
"volume": 256.96428576326844,
"volume_molar": 25.79125165265444,
"formula_full": "Ba4 Tl1 Bi1",
"formula_reduced": "Ba4TlBi",
"formula_anonymous": "ABC4",
"energy_above_hull": 0.0,
"spacegroup": 216
},
{
"id": "jvasp-59859",
"created_at": "2022-09-04T14:38:35.475921Z",
"updated_at": "2022-09-04T14:38:35.475948Z",
"structure_string": "Ba4 Ti4 Cu2 F28\n1.0\n5.225099 -0.002797 0.001717\n-2.608614 7.108687 -0.062475\n-0.004282 -0.517557 15.077795\nBa Ti Cu F\n4 4 2 28\ndirect\n0.765557 0.633285 0.382666 Ba\n0.867594 0.633475 0.882668 Ba\n0.232427 0.364741 0.616523 Ba\n0.132188 0.364888 0.116527 Ba\n0.869533 0.761052 0.130423 Ti\n0.130383 0.237259 0.868904 Ti\n0.891101 0.760914 0.630445 Ti\n0.106454 0.237100 0.368932 Ti\n0.499942 0.999123 0.999646 Cu\n0.498686 0.998835 0.499624 Cu\n0.000394 0.356068 0.780055 F\n0.254816 0.152597 0.976140 F\n0.054883 -0.008950 0.338903 F\n0.745018 0.845618 0.023166 F\n0.897310 0.152324 0.476147 F\n0.513202 0.136017 0.604720 F\n0.834691 0.268395 0.301291 F\n0.642433 0.642256 0.719345 F\n0.100159 0.845294 0.523161 F\n0.377340 0.861881 0.894558 F\n0.063952 0.007142 0.160375 F\n0.841191 0.266841 0.941503 F\n0.433369 0.268456 0.801232 F\n-0.000657 0.642229 0.219304 F\n0.679292 0.514151 0.075404 F\n0.566464 0.729817 0.198092 F\n0.834400 0.513903 0.575532 F\n0.355238 0.356029 0.280084 F\n0.935911 -0.008803 0.838909 F\n0.158713 0.731473 0.057837 F\n0.622524 0.136349 0.104742 F\n0.484064 0.861604 0.394528 F\n0.163015 0.483897 0.424045 F\n0.425241 0.266640 0.441498 F\n0.572397 0.731252 0.557817 F\n0.942695 0.007014 0.660337 F\n0.162932 0.729807 0.698147 F\n0.320631 0.484121 0.923949 F\n",
"nsites": 38,
"nelements": 4,
"elements": [
"Ba",
"Ti",
"Cu",
"F"
],
"chemical_system": "Ba-Cu-F-Ti",
"density": 4.152552226575795,
"density_atomic": 0.06788540097973286,
"volume": 559.766893199097,
"volume_molar": 8.871039535875918,
"formula_full": "Ba4 Ti4 Cu2 F28",
"formula_reduced": "Ba2Ti2CuF14",
"formula_anonymous": "AB2C2D14",
"energy_above_hull": 0.1301496321929823,
"spacegroup": 15
},
{
"id": "jvasp-57132",
"created_at": "2022-09-04T14:38:30.769460Z",
"updated_at": "2022-09-04T14:38:30.769477Z",
"structure_string": "Ba4 Ti2 O2 F12\n1.0\n6.441905 -0.002509 3.366079\n3.080283 6.565208 1.496959\n-0.009282 -0.013356 7.404776\nBa Ti O F\n4 2 2 12\ndirect\n0.844510 0.823435 0.581446 Ba\n0.498910 0.827115 0.172950 Ba\n0.998911 0.172949 0.827116 Ba\n0.344511 0.581445 0.823436 Ba\n0.911963 0.319440 0.331513 Ti\n0.411963 0.331512 0.319441 Ti\n0.637277 0.393608 0.266159 O\n0.137277 0.266158 0.393609 O\n0.733692 0.601926 0.429411 F\n0.733389 0.237725 0.603771 F\n0.553759 0.055686 0.394288 F\n0.215548 0.847821 0.555742 F\n0.715548 0.555740 0.847822 F\n0.233693 0.429410 0.601927 F\n0.233389 0.603770 0.237726 F\n0.053759 0.394288 0.055687 F\n0.393776 0.930919 0.843709 F\n0.893775 0.843708 0.930921 F\n0.020273 0.048433 0.236705 F\n0.520272 0.236705 0.048434 F\n",
"nsites": 20,
"nelements": 4,
"elements": [
"Ba",
"Ti",
"O",
"F"
],
"chemical_system": "Ba-F-O-Ti",
"density": 4.79493838199627,
"density_atomic": 0.06381238338773193,
"volume": 313.41879018179793,
"volume_molar": 9.437260356518465,
"formula_full": "Ba4 Ti2 O2 F12",
"formula_reduced": "Ba2TiOF6",
"formula_anonymous": "ABC2D6",
"energy_above_hull": 0.1958035468333334,
"spacegroup": 9
}
]
}