{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4577","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4575","results":[{"id":"jvasp-108986","created_at":"2022-09-04T14:37:46.443043Z","updated_at":"2022-09-04T14:37:46.443074Z","structure_string":"K2 Ti1 Hg1 F6\n1.0\n5.742108 -0.000000 3.315207\n1.914036 5.413711 3.315207\n-0.000000 -0.000000 6.630415\nK Ti Hg F\n2 1 1 6\ndirect\n0.250000 0.250000 0.250000 K\n0.750001 0.750000 0.750000 K\n0.000000 0.000000 0.000000 Ti\n0.500001 0.500000 0.500000 Hg\n0.200973 0.200973 0.799027 F\n0.200973 0.799027 0.799027 F\n0.799028 0.799027 0.200973 F\n0.200973 0.799027 0.200973 F\n0.799028 0.200973 0.799027 F\n0.799028 0.200973 0.200973 F\n","nsites":10,"nelements":4,"elements":["K","Ti","Hg","F"],"chemical_system":"F-Hg-K-Ti","density":3.550012160222373,"density_atomic":0.048516879849571815,"volume":206.1138315366802,"volume_molar":12.412465060968156,"formula_full":"K2 Ti1 Hg1 F6","formula_reduced":"K2TiHgF6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-40520","created_at":"2022-09-04T14:37:51.207941Z","updated_at":"2022-09-04T14:37:51.207971Z","structure_string":"Rb2 Tl6\n1.0\n4.013112 -6.950914 -0.000000\n4.013112 6.950914 0.000000\n0.000000 0.000000 5.354540\nRb Tl\n2 6\ndirect\n0.333333 0.666667 0.750000 Rb\n0.666667 0.333333 0.250000 Rb\n0.717432 0.858715 0.250000 Tl\n0.141284 0.858715 0.250000 Tl\n0.141284 0.282568 0.250000 Tl\n0.282568 0.141284 0.750000 Tl\n0.858715 0.141284 0.750000 Tl\n0.858715 0.717432 0.750000 Tl\n","nsites":8,"nelements":2,"elements":["Rb","Tl"],"chemical_system":"Rb-Tl","density":7.766821411343278,"density_atomic":0.026780250092750178,"volume":298.7276060639076,"volume_molar":22.487246157683515,"formula_full":"Rb2 Tl6","formula_reduced":"RbTl3","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":194},{"id":"jvasp-21970","created_at":"2022-09-04T14:37:33.702855Z","updated_at":"2022-09-04T14:37:33.702879Z","structure_string":"Rb2 Hf1 F6\n1.0\n3.053895 -5.289500 -0.000000\n3.053895 5.289500 0.000000\n-0.000000 0.000000 4.768708\nRb Hf F\n2 1 6\ndirect\n0.333332 0.666666 0.300923 Rb\n0.666666 0.333332 0.699077 Rb\n0.000000 0.000000 0.000000 Hf\n0.841173 0.682346 0.230969 F\n0.841173 0.158825 0.230969 F\n0.317652 0.158826 0.230969 F\n0.158826 0.317652 0.769031 F\n0.158825 0.841173 0.769031 F\n0.682346 0.841173 0.769031 F\n","nsites":9,"nelements":3,"elements":["Rb","Hf","F"],"chemical_system":"F-Hf-Rb","density":4.994829768126994,"density_atomic":0.05841751262375091,"volume":154.06338948332515,"volume_molar":10.308793527014307,"formula_full":"Rb2 Hf1 F6","formula_reduced":"Rb2HfF6","formula_anonymous":"AB2C6","energy_above_hull":0.0,"spacegroup":164},{"id":"jvasp-39899","created_at":"2022-09-04T14:37:43.705330Z","updated_at":"2022-09-04T14:37:43.705350Z","structure_string":"Tm1 Cd1 Hg2\n1.0\n-0.000000 3.562361 3.562361\n3.562361 -0.000000 3.562361\n3.562361 3.562361 0.000000\nTm Cd Hg\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Tm\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Hg\n0.500001 0.500001 0.500001 Hg\n","nsites":4,"nelements":3,"elements":["Tm","Cd","Hg"],"chemical_system":"Cd-Hg-Tm","density":12.534990706985637,"density_atomic":0.04424011150524171,"volume":90.41568531141851,"volume_molar":13.612399596430668,"formula_full":"Tm1 Cd1 Hg2","formula_reduced":"TmCdHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-40277","created_at":"2022-09-04T14:37:43.705817Z","updated_at":"2022-09-04T14:37:43.705839Z","structure_string":"Li1 Ca2 Tl1\n1.0\n-0.000000 3.817815 3.817815\n3.817815 0.000000 3.817815\n3.817815 3.817815 0.000000\nLi Ca Tl\n1 2 1\ndirect\n0.249999 0.249999 0.249999 Li\n0.499999 0.499999 0.499999 Ca\n0.000000 0.000000 0.000000 Ca\n0.749998 0.749998 0.749998 Tl\n","nsites":4,"nelements":3,"elements":["Li","Ca","Tl"],"chemical_system":"Ca-Li-Tl","density":4.348942541827653,"density_atomic":0.035940602713924755,"volume":111.29473904037363,"volume_molar":16.755814608714932,"formula_full":"Li1 Ca2 Tl1","formula_reduced":"LiCa2Tl","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-21969","created_at":"2022-09-04T14:37:33.466464Z","updated_at":"2022-09-04T14:37:33.466474Z","structure_string":"Rb2 Zr1 F6\n1.0\n3.070734 -5.318667 0.000000\n3.070734 5.318667 -0.000000\n0.000000 -0.000000 4.767223\nRb Zr F\n2 1 6\ndirect\n0.333332 0.666666 0.299646 Rb\n0.666666 0.333332 0.700353 Rb\n0.000000 0.000000 0.000000 Zr\n0.839889 0.679780 0.232323 F\n0.839890 0.160109 0.232323 F\n0.320218 0.160109 0.232323 F\n0.160109 0.320218 0.767677 F\n0.160109 0.839890 0.767677 F\n0.679780 0.839889 0.767677 F\n","nsites":9,"nelements":3,"elements":["Rb","Zr","F"],"chemical_system":"F-Rb-Zr","density":4.011157587978665,"density_atomic":0.05779656770605739,"volume":155.7185894804745,"volume_molar":10.419547386667473,"formula_full":"Rb2 Zr1 F6","formula_reduced":"Rb2ZrF6","formula_anonymous":"AB2C6","energy_above_hull":0.0,"spacegroup":164},{"id":"jvasp-36105","created_at":"2022-09-04T14:37:33.464895Z","updated_at":"2022-09-04T14:37:33.464925Z","structure_string":"Ce2 Zn2 In2\n1.0\n4.769709 0.000166 0.000000\n-2.384712 4.130772 -0.000000\n-0.000000 -0.000000 7.254089\nCe Zn In\n2 2 2\ndirect\n0.000000 0.000000 0.000000 Ce\n0.000000 0.000000 0.500001 Ce\n0.333328 0.666670 0.749999 Zn\n0.666671 0.333327 0.250000 Zn\n0.333336 0.666667 0.250000 In\n0.666664 0.333333 0.749999 In\n","nsites":6,"nelements":3,"elements":["Ce","Zn","In"],"chemical_system":"Ce-In-Zn","density":7.443541570368927,"density_atomic":0.04197942995960334,"volume":142.9271432645412,"volume_molar":14.345456252729218,"formula_full":"Ce2 Zn2 In2","formula_reduced":"CeZnIn","formula_anonymous":"ABC","energy_above_hull":0.0,"spacegroup":194},{"id":"jvasp-23888","created_at":"2022-09-04T14:37:43.745947Z","updated_at":"2022-09-04T14:37:43.745973Z","structure_string":"Sr1 Cl2\n1.0\n4.271915 0.000000 2.466390\n1.423972 4.027599 2.466390\n0.000000 0.000000 4.932782\nSr Cl\n1 2\ndirect\n0.000000 0.000000 0.000000 Sr\n0.749999 0.750000 0.750000 Cl\n0.250000 0.250000 0.250000 Cl\n","nsites":3,"nelements":2,"elements":["Sr","Cl"],"chemical_system":"Cl-Sr","density":3.1016218619655764,"density_atomic":0.035347646651347125,"volume":84.87127953921842,"volume_molar":17.03689306221604,"formula_full":"Sr1 Cl2","formula_reduced":"SrCl2","formula_anonymous":"AB2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-35350","created_at":"2022-09-04T14:37:43.773528Z","updated_at":"2022-09-04T14:37:43.773559Z","structure_string":"Tm1 Cu4 Ag1\n1.0\n-3.547276 -3.547276 -0.000000\n-3.547276 0.000000 -3.547276\n-0.000000 -3.547276 -3.547276\nTm Cu Ag\n1 4 1\ndirect\n0.750001 0.750001 0.750001 Tm\n0.374283 0.374283 0.374283 Cu\n0.877153 0.374283 0.374283 Cu\n0.374283 0.877153 0.374283 Cu\n0.374283 0.374283 0.877153 Cu\n0.000000 0.000000 0.000000 Ag\n","nsites":6,"nelements":3,"elements":["Tm","Cu","Ag"],"chemical_system":"Ag-Cu-Tm","density":9.87682970989966,"density_atomic":0.06721037413683031,"volume":89.2719327493237,"volume_molar":8.960135748894686,"formula_full":"Tm1 Cu4 Ag1","formula_reduced":"TmCu4Ag","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-12503","created_at":"2022-09-04T14:37:33.425537Z","updated_at":"2022-09-04T14:37:33.425569Z","structure_string":"Xe2 F8\n1.0\n0.000000 5.008622 -0.034381\n5.777211 0.000000 0.000000\n0.000000 -3.998570 -5.713121\nXe F\n2 8\ndirect\n-0.000000 0.500000 0.500000 Xe\n0.000000 0.000000 0.000000 Xe\n0.444620 0.346796 0.652031 F\n0.555380 0.846796 0.847969 F\n0.074345 0.976185 0.320628 F\n0.925655 0.476185 0.179372 F\n0.925655 0.023815 0.679372 F\n0.074345 0.523815 0.820627 F\n0.444620 0.153204 0.152031 F\n0.555380 0.653204 0.347969 F\n","nsites":10,"nelements":2,"elements":["Xe","F"],"chemical_system":"F-Xe","density":4.144374071003147,"density_atomic":0.06020167846145668,"volume":166.10832547471855,"volume_molar":10.003277174166488,"formula_full":"Xe2 F8","formula_reduced":"XeF4","formula_anonymous":"AB4","energy_above_hull":0.0,"spacegroup":14},{"id":"jvasp-39711","created_at":"2022-09-04T14:37:43.777027Z","updated_at":"2022-09-04T14:37:43.777049Z","structure_string":"Yb1 Ga1 Au2\n1.0\n0.000000 3.409004 3.409004\n3.409004 -0.000000 3.409004\n3.409004 3.409004 -0.000000\nYb Ga Au\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Yb\n0.249999 0.249999 0.249999 Ga\n0.000000 0.000000 0.000000 Au\n0.500000 0.500000 0.500000 Au\n","nsites":4,"nelements":3,"elements":["Yb","Ga","Au"],"chemical_system":"Au-Ga-Yb","density":13.343470042701593,"density_atomic":0.05048326826933673,"volume":79.23417276907126,"volume_molar":11.928983535437654,"formula_full":"Yb1 Ga1 Au2","formula_reduced":"YbGaAu2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-41746","created_at":"2022-09-04T14:37:43.969705Z","updated_at":"2022-09-04T14:37:43.969714Z","structure_string":"Li1 Dy1 Hg2\n1.0\n0.000000 3.528588 3.528588\n3.528588 0.000000 3.528588\n3.528588 3.528588 0.000000\nLi Dy Hg\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Li\n0.250001 0.250001 0.250001 Dy\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n","nsites":4,"nelements":3,"elements":["Li","Dy","Hg"],"chemical_system":"Dy-Hg-Li","density":10.783605555814146,"density_atomic":0.04552260823199485,"volume":87.8684274770676,"volume_molar":13.228900965668819,"formula_full":"Li1 Dy1 Hg2","formula_reduced":"LiDyHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225}]}