{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=494","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=492","results":[{"id":"jvasp-64335","created_at":"2022-09-04T14:35:59.169601Z","updated_at":"2022-09-04T14:35:59.169641Z","structure_string":"Ba4 Ga1 Pb1\n1.0\n-0.000000 5.018679 5.018679\n5.018679 -0.000000 5.018679\n5.018679 5.018679 0.000000\nBa Ga Pb\n4 1 1\ndirect\n0.123651 0.625449 0.625449 Ba\n0.625449 0.625449 0.625449 Ba\n0.625449 0.123651 0.625449 Ba\n0.625449 0.625449 0.123651 Ba\n0.250000 0.250000 0.250000 Ga\n0.000000 0.000000 0.000000 Pb\n","nsites":6,"nelements":3,"elements":["Ba","Ga","Pb"],"chemical_system":"Ba-Ga-Pb","density":5.4269064033728815,"density_atomic":0.023733019649771713,"volume":252.81233018562446,"volume_molar":25.374523970690458,"formula_full":"Ba4 Ga1 Pb1","formula_reduced":"Ba4GaPb","formula_anonymous":"ABC4","energy_above_hull":0.0166136566666666,"spacegroup":216},{"id":"jvasp-42671","created_at":"2022-09-04T14:36:18.532184Z","updated_at":"2022-09-04T14:36:18.532209Z","structure_string":"Sr2 Ca2 I8\n1.0\n-0.000004 7.858602 0.000000\n3.929304 -3.929300 8.113796\n7.858602 0.000004 -0.000000\nSr Ca I\n2 2 8\ndirect\n0.625000 0.750000 0.125000 Sr\n0.374999 0.250000 0.875000 Sr\n0.875000 0.250000 0.375000 Ca\n0.125000 0.750000 0.624999 Ca\n0.571199 0.055874 0.212796 I\n0.231331 0.444126 0.071199 I\n0.712796 0.444126 0.484675 I\n0.015325 0.944126 0.268668 I\n0.984674 0.055874 0.731331 I\n0.287204 0.555874 0.515324 I\n0.768669 0.555874 0.928801 I\n0.428801 0.944126 0.787203 I\n","nsites":12,"nelements":3,"elements":["Sr","Ca","I"],"chemical_system":"Ca-I-Sr","density":4.210698356586848,"density_atomic":0.023947852406928333,"volume":501.0887738947435,"volume_molar":25.14689274708299,"formula_full":"Sr2 Ca2 I8","formula_reduced":"SrCaI4","formula_anonymous":"ABC4","energy_above_hull":0.0166149999999999,"spacegroup":88},{"id":"jvasp-64381","created_at":"2022-09-04T14:35:53.359989Z","updated_at":"2022-09-04T14:35:53.360017Z","structure_string":"Ba4 Sn1 Hg1\n1.0\n-0.000000 5.014989 5.014989\n5.014989 0.000000 5.014989\n5.014989 5.014989 -0.000000\nBa Sn Hg\n4 1 1\ndirect\n0.122177 0.625941 0.625941 Ba\n0.625941 0.625941 0.625941 Ba\n0.625941 0.122177 0.625941 Ba\n0.625941 0.625941 0.122177 Ba\n0.000000 0.000000 0.000000 Sn\n0.250000 0.250000 0.250000 Hg\n","nsites":6,"nelements":3,"elements":["Ba","Sn","Hg"],"chemical_system":"Ba-Hg-Sn","density":5.717852822942416,"density_atomic":0.02378544606309553,"volume":252.25509683879088,"volume_molar":25.31859500984383,"formula_full":"Ba4 Sn1 Hg1","formula_reduced":"Ba4SnHg","formula_anonymous":"ABC4","energy_above_hull":0.0167386566666666,"spacegroup":216},{"id":"jvasp-51430","created_at":"2022-09-04T14:37:15.226418Z","updated_at":"2022-09-04T14:37:15.226427Z","structure_string":"Al2 F6\n1.0\n3.549898 -0.652911 -0.390818\n1.036150 5.143011 0.543337\n0.982850 1.907036 5.525837\nAl F\n2 6\ndirect\n0.305776 0.558002 0.520328 Al\n0.305657 0.827707 0.982891 Al\n0.305709 0.192859 0.751605 F\n0.305722 0.692861 0.751608 F\n0.805672 0.831157 -0.023635 F\n0.805762 0.554579 0.526855 F\n0.303683 0.914741 0.252377 F\n0.307747 0.470959 0.250838 F\n","nsites":8,"nelements":2,"elements":["Al","F"],"chemical_system":"Al-F","density":2.739600277396196,"density_atomic":0.07858488858379675,"volume":101.80074240952099,"volume_molar":7.663230003282963,"formula_full":"Al2 F6","formula_reduced":"AlF3","formula_anonymous":"AB3","energy_above_hull":0.0167399999999999,"spacegroup":65},{"id":"jvasp-36991","created_at":"2022-09-04T14:38:05.135069Z","updated_at":"2022-09-04T14:38:05.135094Z","structure_string":"K1 Ca1 Br3\n1.0\n5.663488 -0.023008 -0.014217\n-0.005135 5.639005 -0.004383\n-0.012470 0.006875 5.639065\nK Ca Br\n1 1 3\ndirect\n0.929543 0.012628 0.010208 K\n0.520170 0.500574 0.498650 Ca\n0.542891 0.502735 -0.001698 Br\n0.024317 0.493837 0.491973 Br\n0.543080 0.000223 0.500870 Br\n","nsites":5,"nelements":3,"elements":["K","Ca","Br"],"chemical_system":"Br-Ca-K","density":2.940341174935166,"density_atomic":0.027763872873358113,"volume":180.09014890706914,"volume_molar":21.690564524154613,"formula_full":"K1 Ca1 Br3","formula_reduced":"KCaBr3","formula_anonymous":"ABC3","energy_above_hull":0.0167700000000001,"spacegroup":8},{"id":"jvasp-22570","created_at":"2022-09-04T14:36:46.673490Z","updated_at":"2022-09-04T14:36:46.673524Z","structure_string":"K3 Mo1 F6\n1.0\n5.515206 -0.000000 3.184206\n1.838402 5.199786 3.184206\n-0.000000 -0.000000 6.368411\nK Mo F\n3 1 6\ndirect\n0.500000 0.500000 0.500000 K\n0.750000 0.750001 0.750001 K\n0.250000 0.250000 0.250000 K\n0.000000 0.000000 0.000000 Mo\n0.227489 0.772511 0.772511 F\n0.227489 0.772511 0.227490 F\n0.772511 0.227490 0.772511 F\n0.227489 0.227490 0.772511 F\n0.772511 0.227490 0.227490 F\n0.772511 0.772511 0.227490 F\n","nsites":10,"nelements":3,"elements":["K","Mo","F"],"chemical_system":"F-K-Mo","density":2.975210545908386,"density_atomic":0.05475473825831178,"volume":182.63259615677185,"volume_molar":10.998392014203151,"formula_full":"K3 Mo1 F6","formula_reduced":"K3MoF6","formula_anonymous":"AB3C6","energy_above_hull":0.0168231595,"spacegroup":225},{"id":"jvasp-91575","created_at":"2022-09-04T14:36:04.478377Z","updated_at":"2022-09-04T14:36:04.478397Z","structure_string":"Bi2 I6\n1.0\n-0.010326 0.000000 -4.155232\n6.955575 0.000000 2.060919\n0.000000 -11.205223 0.000000\nBi I\n2 6\ndirect\n0.727728 0.954772 0.250000 Bi\n0.272271 0.045226 0.750000 Bi\n0.867714 0.235517 0.573510 I\n0.132284 0.764482 0.073510 I\n0.132284 0.764482 0.426490 I\n0.867714 0.235517 0.926489 I\n0.397647 0.295235 0.250000 I\n0.602352 0.704763 0.750000 I\n","nsites":8,"nelements":2,"elements":["Bi","I"],"chemical_system":"Bi-I","density":6.051690926623337,"density_atomic":0.024720717084505184,"volume":323.6152079510007,"volume_molar":24.360704179469966,"formula_full":"Bi2 I6","formula_reduced":"BiI3","formula_anonymous":"AB3","energy_above_hull":0.0169875,"spacegroup":63},{"id":"jvasp-25080","created_at":"2022-09-04T14:37:58.810639Z","updated_at":"2022-09-04T14:37:58.810651Z","structure_string":"Ho1\n1.0\n3.013595 0.000000 1.739899\n1.004532 2.841245 1.739899\n0.000000 0.000000 3.479800\nHo\n1\ndirect\n0.000000 0.000000 0.000000 Ho\n","nsites":1,"nelements":1,"elements":["Ho"],"chemical_system":"Ho","density":9.191824932515459,"density_atomic":0.03356233323503824,"volume":29.795306333351846,"volume_molar":17.943152872676432,"formula_full":"Ho1","formula_reduced":"Ho","formula_anonymous":"A","energy_above_hull":0.0170000000000001,"spacegroup":225},{"id":"jvasp-16340","created_at":"2022-09-04T14:38:29.049302Z","updated_at":"2022-09-04T14:38:29.049331Z","structure_string":"Ho1\n1.0\n3.013589 0.000000 1.739896\n1.004529 2.841239 1.739896\n0.000000 0.000000 3.479792\nHo\n1\ndirect\n0.000000 0.000000 0.000000 Ho\n","nsites":1,"nelements":1,"elements":["Ho"],"chemical_system":"Ho","density":9.191883776169552,"density_atomic":0.03356254809229912,"volume":29.79511559283095,"volume_molar":17.943038006049886,"formula_full":"Ho1","formula_reduced":"Ho","formula_anonymous":"A","energy_above_hull":0.0170000000000001,"spacegroup":225},{"id":"jvasp-117872","created_at":"2022-09-04T14:38:54.127024Z","updated_at":"2022-09-04T14:38:54.127053Z","structure_string":"Pb1 Br2\n1.0\n4.457896 0.309889 -0.420742\n0.281384 -4.081760 -0.025392\n-0.371967 -2.043127 -5.446237\nPb Br\n1 2\ndirect\n0.969105 0.160750 -0.005275 Pb\n0.469076 0.576903 0.162574 Br\n0.969070 0.860820 0.594777 Br\n","nsites":3,"nelements":2,"elements":["Pb","Br"],"chemical_system":"Br-Pb","density":6.080489705045594,"density_atomic":0.029931961896882114,"volume":100.22730919995249,"volume_molar":20.119432133271896,"formula_full":"Pb1 Br2","formula_reduced":"PbBr2","formula_anonymous":"AB2","energy_above_hull":0.01705,"spacegroup":38},{"id":"jvasp-104542","created_at":"2022-09-04T14:36:49.282441Z","updated_at":"2022-09-04T14:36:49.282471Z","structure_string":"Na6 O3\n1.0\n6.117273 -0.000000 0.000000\n-3.058636 5.297714 0.000000\n-0.000000 -0.000000 3.599753\nNa O\n6 3\ndirect\n0.413950 0.000000 -0.000000 Na\n0.260180 0.260181 0.500000 Na\n-0.000001 0.739819 0.500000 Na\n-0.000000 0.413950 -0.000000 Na\n0.739819 0.000000 0.500000 Na\n0.586049 0.586049 -0.000000 Na\n0.333333 0.666666 0.500000 O\n0.000000 0.000000 0.000000 O\n0.666666 0.333333 0.500000 O\n","nsites":9,"nelements":2,"elements":["Na","O"],"chemical_system":"Na-O","density":2.6466432956278574,"density_atomic":0.07714778040862874,"volume":116.65922146210416,"volume_molar":7.805980584408937,"formula_full":"Na6 O3","formula_reduced":"Na2O","formula_anonymous":"AB2","energy_above_hull":0.0170766666666667,"spacegroup":189},{"id":"jvasp-18591","created_at":"2022-09-04T14:36:33.207319Z","updated_at":"2022-09-04T14:36:33.207339Z","structure_string":"Na2 Ag4\n1.0\n4.871370 0.000000 2.812486\n1.623790 4.592771 2.812486\n0.000000 -0.000000 5.624973\nNa Ag\n2 4\ndirect\n0.125000 0.125000 0.125000 Na\n0.875000 0.875000 0.875001 Na\n0.000000 0.500000 0.500000 Ag\n0.500000 -0.000000 0.500000 Ag\n0.500000 0.500000 0.000001 Ag\n0.500000 0.500000 0.500000 Ag\n","nsites":6,"nelements":2,"elements":["Na","Ag"],"chemical_system":"Ag-Na","density":6.299887169109718,"density_atomic":0.047676558584295016,"volume":125.84800954942334,"volume_molar":12.63124046454086,"formula_full":"Na2 Ag4","formula_reduced":"NaAg2","formula_anonymous":"AB2","energy_above_hull":0.0171216666666666,"spacegroup":227}]}