{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=545","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=543","results":[{"id":"jvasp-102418","created_at":"2022-09-04T14:36:41.912178Z","updated_at":"2022-09-04T14:36:41.912188Z","structure_string":"Rb2 In2 Cl6\n1.0\n6.674939 -0.000000 3.853778\n2.224980 6.293192 3.853778\n0.000000 -0.000000 7.707555\nRb In Cl\n2 2 6\ndirect\n0.750000 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.500001 In\n0.000000 0.000000 0.000000 In\n0.766257 0.233743 0.233744 Cl\n0.233743 0.233743 0.766257 Cl\n0.233743 0.766257 0.766258 Cl\n0.233743 0.766257 0.233744 Cl\n0.766257 0.233743 0.766258 Cl\n0.766257 0.766257 0.233744 Cl\n","nsites":10,"nelements":3,"elements":["Rb","In","Cl"],"chemical_system":"Cl-In-Rb","density":3.1454282428028524,"density_atomic":0.03088624303295581,"volume":323.76874032008163,"volume_molar":19.497809278954186,"formula_full":"Rb2 In2 Cl6","formula_reduced":"RbInCl3","formula_anonymous":"ABC3","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-2769","created_at":"2022-09-04T14:36:41.956184Z","updated_at":"2022-09-04T14:36:41.956192Z","structure_string":"Sn2 F6\n1.0\n5.362497 -0.000000 3.096039\n1.787499 5.055810 3.096039\n-0.000000 -0.000000 6.192078\nSn F\n2 6\ndirect\n0.500000 0.500000 0.500000 Sn\n0.000000 0.000000 0.000000 Sn\n0.270924 0.729077 0.729077 F\n0.270924 0.729077 0.270923 F\n0.729077 0.270923 0.270923 F\n0.729077 0.729077 0.270923 F\n0.270923 0.270923 0.729077 F\n0.729077 0.270923 0.729077 F\n","nsites":8,"nelements":2,"elements":["Sn","F"],"chemical_system":"F-Sn","density":3.475917870298018,"density_atomic":0.04765360512649911,"volume":167.87816952701817,"volume_molar":12.637324592785577,"formula_full":"Sn2 F6","formula_reduced":"SnF3","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-79425","created_at":"2022-09-04T14:36:41.977448Z","updated_at":"2022-09-04T14:36:41.977465Z","structure_string":"Li3 Ga1\n1.0\n-2.227109 2.227109 3.154031\n2.227109 -2.227109 3.154031\n2.227109 2.227109 -3.154031\nLi Ga\n3 1\ndirect\n0.749999 0.249999 0.500000 Li\n0.249999 0.749999 0.500000 Li\n0.500000 0.500000 0.000000 Li\n0.000000 0.000000 0.000000 Ga\n","nsites":4,"nelements":2,"elements":["Li","Ga"],"chemical_system":"Ga-Li","density":2.402754903098314,"density_atomic":0.06392210917429213,"volume":62.576157947064424,"volume_molar":9.421060784430365,"formula_full":"Li3 Ga1","formula_reduced":"Li3Ga","formula_anonymous":"AB3","energy_above_hull":0.4183050000000001,"spacegroup":225},{"id":"jvasp-102131","created_at":"2022-09-04T14:36:42.024473Z","updated_at":"2022-09-04T14:36:42.024495Z","structure_string":"Ti2 Ir1 Ru1\n1.0\n3.789493 0.000000 2.187865\n1.263164 3.572768 2.187865\n0.000000 0.000000 4.375730\nTi Ir Ru\n2 1 1\ndirect\n0.249999 0.250000 0.250000 Ti\n0.749998 0.750000 0.749999 Ti\n0.499999 0.500000 0.499999 Ir\n0.000000 0.000000 0.000000 Ru\n","nsites":4,"nelements":3,"elements":["Ti","Ir","Ru"],"chemical_system":"Ir-Ru-Ti","density":10.903996459642302,"density_atomic":0.06751861883980573,"volume":59.242918008888424,"volume_molar":8.919229782066626,"formula_full":"Ti2 Ir1 Ru1","formula_reduced":"Ti2IrRu","formula_anonymous":"ABC2","energy_above_hull":3.986769566666667,"spacegroup":225},{"id":"jvasp-103335","created_at":"2022-09-04T14:36:42.254212Z","updated_at":"2022-09-04T14:36:42.254234Z","structure_string":"Yb2 H6 Ru1\n1.0\n4.321925 0.000000 2.495265\n1.440641 4.074751 2.495265\n-0.000000 0.000000 4.990530\nYb H Ru\n2 6 1\ndirect\n0.250000 0.250000 0.249999 Yb\n0.750001 0.750000 0.749998 Yb\n0.756389 0.243612 0.243611 H\n0.756389 0.756388 0.243610 H\n0.243612 0.756388 0.243611 H\n0.756389 0.243612 0.756387 H\n0.243612 0.243612 0.756388 H\n0.243612 0.756388 0.756387 H\n0.000000 0.000000 0.000000 Ru\n","nsites":9,"nelements":3,"elements":["Yb","H","Ru"],"chemical_system":"H-Ru-Yb","density":8.562720442426102,"density_atomic":0.10240414541782605,"volume":87.88706710337256,"volume_molar":5.880758767556389,"formula_full":"Yb2 H6 Ru1","formula_reduced":"Yb2H6Ru","formula_anonymous":"AB2C6","energy_above_hull":2.3348424333333337,"spacegroup":225},{"id":"jvasp-100895","created_at":"2022-09-04T14:36:41.979147Z","updated_at":"2022-09-04T14:36:41.979166Z","structure_string":"K2 Na1 Sc1 Br6\n1.0\n6.664718 -0.000000 3.847877\n2.221573 6.283556 3.847877\n-0.000000 -0.000000 7.695753\nK Na Sc Br\n2 1 1 6\ndirect\n0.750000 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Na\n0.000000 0.000000 0.000000 Sc\n0.758060 0.241940 0.241940 Br\n0.241940 0.241940 0.758060 Br\n0.241940 0.758060 0.758060 Br\n0.241940 0.758060 0.241941 Br\n0.758060 0.241940 0.758060 Br\n0.758059 0.758060 0.241941 Br\n","nsites":10,"nelements":4,"elements":["K","Na","Sc","Br"],"chemical_system":"Br-K-Na-Sc","density":3.223176150233198,"density_atomic":0.031028559336622963,"volume":322.2837351715848,"volume_molar":19.40838017861846,"formula_full":"K2 Na1 Sc1 Br6","formula_reduced":"K2NaScBr6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-102994","created_at":"2022-09-04T14:36:42.034279Z","updated_at":"2022-09-04T14:36:42.034297Z","structure_string":"Tm1 Sb1 Rh2\n1.0\n4.047636 -0.000000 2.336904\n1.349212 3.816148 2.336904\n0.000000 0.000000 4.673808\nTm Sb Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Tm\n0.500000 0.500000 0.499999 Sb\n0.250000 0.250000 0.250000 Rh\n0.750000 0.750000 0.749999 Rh\n","nsites":4,"nelements":3,"elements":["Tm","Sb","Rh"],"chemical_system":"Rh-Sb-Tm","density":11.4202439379446,"density_atomic":0.05540672294786677,"volume":72.19340518954127,"volume_molar":10.868971199878299,"formula_full":"Tm1 Sb1 Rh2","formula_reduced":"TmSbRh2","formula_anonymous":"ABC2","energy_above_hull":2.0005215875,"spacegroup":225},{"id":"jvasp-100766","created_at":"2022-09-04T14:36:42.110764Z","updated_at":"2022-09-04T14:36:42.110777Z","structure_string":"Y1 Ho1 In2\n1.0\n4.575139 0.000000 2.641458\n1.525046 4.313482 2.641458\n0.000000 -0.000000 5.282915\nY Ho In\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Y\n0.500001 0.500000 0.500001 Ho\n0.750001 0.750000 0.750001 In\n0.250000 0.250000 0.250000 In\n","nsites":4,"nelements":3,"elements":["Y","Ho","In"],"chemical_system":"Ho-In-Y","density":7.70042456978585,"density_atomic":0.0383666680851875,"volume":104.25716382560489,"volume_molar":15.69628289490432,"formula_full":"Y1 Ho1 In2","formula_reduced":"YHoIn2","formula_anonymous":"ABC2","energy_above_hull":0.7079302391666665,"spacegroup":225},{"id":"jvasp-36222","created_at":"2022-09-04T14:36:42.148192Z","updated_at":"2022-09-04T14:36:42.148220Z","structure_string":"Ti1 O2\n1.0\n2.413397 2.413397 -0.000000\n2.413397 -0.000000 -2.413397\n0.000000 2.413397 -2.413397\nTi O\n1 2\ndirect\n0.000000 0.000000 0.000000 Ti\n0.250000 0.250000 0.250000 O\n0.750001 0.750001 0.750001 O\n","nsites":3,"nelements":2,"elements":["Ti","O"],"chemical_system":"O-Ti","density":4.717301586366027,"density_atomic":0.10670995909494975,"volume":28.113589635346234,"volume_molar":5.64346646843107,"formula_full":"Ti1 O2","formula_reduced":"TiO2","formula_anonymous":"AB2","energy_above_hull":1.5606784444444446,"spacegroup":225},{"id":"jvasp-101015","created_at":"2022-09-04T14:36:41.987982Z","updated_at":"2022-09-04T14:36:41.988002Z","structure_string":"Sc2 Cd1 Au1\n1.0\n4.223112 -0.000000 2.438215\n1.407704 3.981588 2.438215\n-0.000000 -0.000000 4.876430\nSc Cd Au\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Sc\n0.749999 0.750000 0.749999 Sc\n0.000000 0.000000 0.000000 Cd\n0.499999 0.500000 0.499999 Au\n","nsites":4,"nelements":3,"elements":["Sc","Cd","Au"],"chemical_system":"Au-Cd-Sc","density":8.086227547972186,"density_atomic":0.048783064495887166,"volume":81.99566881119645,"volume_molar":12.344736482284171,"formula_full":"Sc2 Cd1 Au1","formula_reduced":"Sc2CdAu","formula_anonymous":"ABC2","energy_above_hull":0.786029455,"spacegroup":225},{"id":"jvasp-100735","created_at":"2022-09-04T14:36:42.001914Z","updated_at":"2022-09-04T14:36:42.001923Z","structure_string":"Mg2 Ir1 Au1\n1.0\n3.899195 -0.000000 2.251201\n1.299732 3.676196 2.251201\n-0.000000 -0.000000 4.502403\nMg Ir Au\n2 1 1\ndirect\n0.249999 0.250000 0.250000 Mg\n0.749998 0.750001 0.750000 Mg\n0.000000 0.000000 0.000000 Ir\n0.499999 0.500001 0.500000 Au\n","nsites":4,"nelements":3,"elements":["Mg","Ir","Au"],"chemical_system":"Au-Ir-Mg","density":11.264203734459683,"density_atomic":0.06197863583663201,"volume":64.53836787475451,"volume_molar":9.716478394060843,"formula_full":"Mg2 Ir1 Au1","formula_reduced":"Mg2IrAu","formula_anonymous":"ABC2","energy_above_hull":0.7088491924999999,"spacegroup":225},{"id":"jvasp-78661","created_at":"2022-09-04T14:36:42.007861Z","updated_at":"2022-09-04T14:36:42.007886Z","structure_string":"Tl1 Br1\n1.0\n4.072069 -0.000000 2.351010\n1.357356 3.839184 2.351010\n-0.000000 -0.000000 4.702020\nTl Br\n1 1\ndirect\n0.000000 0.000000 0.000000 Tl\n0.500001 0.499999 0.500000 Br\n","nsites":2,"nelements":2,"elements":["Tl","Br"],"chemical_system":"Br-Tl","density":6.4219663982991575,"density_atomic":0.027207677317919347,"volume":73.50866362571762,"volume_molar":22.133975971678172,"formula_full":"Tl1 Br1","formula_reduced":"TlBr","formula_anonymous":"AB","energy_above_hull":0.0020499999999999,"spacegroup":225}]}