{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4329","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-energy_above_hull&page=4327","results":[{"id":"jvasp-36960","created_at":"2022-09-04T14:37:58.338334Z","updated_at":"2022-09-04T14:37:58.338359Z","structure_string":"Rb4 Ca4 I12\n1.0\n4.637942 -0.000000 0.000000\n-0.000000 10.354578 0.000000\n0.000000 0.000000 17.060312\nRb Ca I\n4 4 12\ndirect\n0.750000 0.071631 0.323689 Rb\n0.250000 0.928369 0.676311 Rb\n0.750000 0.571632 0.176311 Rb\n0.250000 0.428369 0.823689 Rb\n0.250000 0.167056 0.056142 Ca\n0.750000 0.832944 0.943858 Ca\n0.250000 0.667056 0.443858 Ca\n0.750000 0.332944 0.556142 Ca\n0.750000 0.704570 0.783735 I\n0.250000 0.295431 0.216265 I\n0.750000 0.476344 0.392740 I\n0.250000 0.523656 0.607260 I\n0.750000 0.976344 0.107260 I\n0.250000 0.662510 0.010649 I\n0.250000 0.162510 0.489351 I\n0.750000 0.837490 0.510648 I\n0.250000 0.795431 0.283735 I\n0.750000 0.337490 0.989351 I\n0.250000 0.023656 0.892740 I\n0.750000 0.204569 0.716265 I\n","nsites":20,"nelements":3,"elements":["Rb","Ca","I"],"chemical_system":"Ca-I-Rb","density":4.104283383818749,"density_atomic":0.024410985298249813,"volume":819.3032667728464,"volume_molar":24.669797988169563,"formula_full":"Rb4 Ca4 I12","formula_reduced":"RbCaI3","formula_anonymous":"ABC3","energy_above_hull":0.0,"spacegroup":62},{"id":"jvasp-20292","created_at":"2022-09-04T14:37:58.363146Z","updated_at":"2022-09-04T14:37:58.363159Z","structure_string":"Nd6 F18\n1.0\n3.525382 -6.106141 0.000000\n3.525382 6.106141 -0.000000\n0.000000 -0.000000 7.246496\nNd F\n6 18\ndirect\n0.343898 -0.000000 0.250000 Nd\n-0.000000 0.343898 0.250000 Nd\n0.656101 0.656101 0.250000 Nd\n0.656101 -0.000000 0.750000 Nd\n-0.000000 0.656101 0.750000 Nd\n0.343898 0.343898 0.750000 Nd\n0.628891 0.690191 0.919085 F\n0.371108 0.061300 0.580916 F\n0.938700 0.309808 0.580916 F\n0.690191 0.628891 0.580916 F\n0.938700 0.628891 0.080916 F\n0.690191 0.061300 0.080916 F\n0.371108 0.309808 0.080916 F\n0.628891 0.938700 0.419084 F\n0.333333 0.666667 0.679920 F\n0.309808 0.371108 0.419084 F\n0.309808 0.938700 0.919085 F\n0.666667 0.333333 0.820081 F\n0.666667 0.333333 0.320081 F\n0.333333 0.666667 0.179919 F\n0.000000 0.000000 0.750000 F\n0.000000 0.000000 0.250000 F\n0.061300 0.690191 0.419084 F\n0.061300 0.371108 0.919085 F\n","nsites":24,"nelements":2,"elements":["Nd","F"],"chemical_system":"F-Nd","density":6.42654526328962,"density_atomic":0.0769272447502985,"volume":311.9830962086664,"volume_molar":7.828358833788381,"formula_full":"Nd6 F18","formula_reduced":"NdF3","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":165},{"id":"jvasp-33820","created_at":"2022-09-04T14:37:58.368292Z","updated_at":"2022-09-04T14:37:58.368323Z","structure_string":"Dy2 I6\n1.0\n10.480601 0.000000 0.000000\n-5.240301 9.076466 -0.000000\n-0.000000 -0.000000 3.986331\nDy I\n2 6\ndirect\n0.333332 0.666667 0.749999 Dy\n0.666666 0.333333 0.249998 Dy\n0.206417 0.412836 0.249998 I\n0.587164 0.793582 0.249998 I\n0.206417 0.793582 0.249998 I\n0.793582 0.587164 0.749999 I\n0.412837 0.206418 0.749999 I\n0.793583 0.206418 0.749999 I\n","nsites":8,"nelements":2,"elements":["Dy","I"],"chemical_system":"Dy-I","density":4.757439192655067,"density_atomic":0.021096657746509154,"volume":379.2069860603276,"volume_molar":28.545473090383133,"formula_full":"Dy2 I6","formula_reduced":"DyI3","formula_anonymous":"AB3","energy_above_hull":0.0,"spacegroup":194},{"id":"jvasp-109894","created_at":"2022-09-04T14:37:57.032053Z","updated_at":"2022-09-04T14:37:57.032071Z","structure_string":"K1 Rb2 As1 I6\n1.0\n7.490053 -0.000000 4.324384\n2.496684 7.061690 4.324384\n-0.000000 -0.000000 8.648768\nK Rb As I\n1 2 1 6\ndirect\n0.499999 0.500000 0.500000 K\n0.749999 0.750000 0.750000 Rb\n0.250000 0.250000 0.250000 Rb\n0.000000 0.000000 0.000000 As\n0.765662 0.234338 0.234337 I\n0.234337 0.234338 0.765662 I\n0.234337 0.765662 0.765662 I\n0.234337 0.765662 0.234338 I\n0.765662 0.234338 0.765662 I\n0.765662 0.765662 0.234337 I\n","nsites":10,"nelements":4,"elements":["K","Rb","As","I"],"chemical_system":"As-I-K-Rb","density":3.7983213411954138,"density_atomic":0.021860103462275186,"volume":457.45437652010116,"volume_molar":27.548546466820884,"formula_full":"K1 Rb2 As1 I6","formula_reduced":"KRb2AsI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-37872","created_at":"2022-09-04T14:37:58.409954Z","updated_at":"2022-09-04T14:37:58.409977Z","structure_string":"Ac1 Tl1 Hg2\n1.0\n0.000000 3.862574 3.862574\n3.862574 -0.000000 3.862574\n3.862574 3.862574 -0.000000\nAc Tl Hg\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ac\n0.749999 0.749999 0.749999 Tl\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n","nsites":4,"nelements":3,"elements":["Ac","Tl","Hg"],"chemical_system":"Ac-Hg-Tl","density":11.995156714104665,"density_atomic":0.03470560001650842,"volume":115.25517490253212,"volume_molar":17.352072164536693,"formula_full":"Ac1 Tl1 Hg2","formula_reduced":"AcTlHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-56857","created_at":"2022-09-04T14:37:58.391132Z","updated_at":"2022-09-04T14:37:58.391154Z","structure_string":"Rb2 Cu4 Br6\n1.0\n5.275352 0.000000 0.000000\n-0.000000 7.868289 -1.798735\n-0.000000 0.030617 8.071213\nRb Cu Br\n2 4 6\ndirect\n0.750000 0.701556 0.298445 Rb\n0.250000 0.298445 0.701556 Rb\n0.000000 0.822133 0.822133 Cu\n0.500000 0.822133 0.822133 Cu\n0.500000 0.177868 0.177868 Cu\n0.000000 0.177868 0.177868 Cu\n0.750000 0.573344 0.839556 Br\n0.750000 0.109393 0.890607 Br\n0.250000 0.426656 0.160445 Br\n0.750000 0.160445 0.426656 Br\n0.250000 0.890608 0.109393 Br\n0.250000 0.839556 0.573344 Br\n","nsites":12,"nelements":3,"elements":["Rb","Cu","Br"],"chemical_system":"Br-Cu-Rb","density":4.479521218590352,"density_atomic":0.03578773736290469,"volume":335.31038518345787,"volume_molar":16.82738614887168,"formula_full":"Rb2 Cu4 Br6","formula_reduced":"RbCu2Br3","formula_anonymous":"AB2C3","energy_above_hull":0.0,"spacegroup":63},{"id":"jvasp-40287","created_at":"2022-09-04T14:37:49.315865Z","updated_at":"2022-09-04T14:37:49.315890Z","structure_string":"Pr1 Mg1 Cd2\n1.0\n0.000000 3.671125 3.671125\n3.671125 -0.000000 3.671125\n3.671125 3.671125 0.000000\nPr Mg Cd\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Pr\n0.250001 0.250001 0.250001 Mg\n0.000000 0.000000 0.000000 Cd\n0.499999 0.499999 0.499999 Cd\n","nsites":4,"nelements":3,"elements":["Pr","Mg","Cd"],"chemical_system":"Cd-Mg-Pr","density":6.545227941250809,"density_atomic":0.040423366469741914,"volume":98.95266894691015,"volume_molar":14.897672524399349,"formula_full":"Pr1 Mg1 Cd2","formula_reduced":"PrMgCd2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-57802","created_at":"2022-09-04T14:37:58.404486Z","updated_at":"2022-09-04T14:37:58.404513Z","structure_string":"K2 Fe2 F8\n1.0\n3.987471 0.000000 -0.000000\n-1.993736 5.982370 -0.000000\n0.000000 0.000000 7.732994\nK Fe F\n2 2 8\ndirect\n0.727707 0.455414 0.750000 K\n0.272292 0.544586 0.250000 K\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.154254 0.308509 0.553309 F\n0.845745 0.691491 0.446690 F\n0.845745 0.691491 0.053309 F\n0.154254 0.308509 0.946690 F\n0.500000 -0.000000 0.000000 F\n0.500000 -0.000000 0.500000 F\n0.958166 0.916336 0.750000 F\n0.041833 0.083664 0.250000 F\n","nsites":12,"nelements":3,"elements":["K","Fe","F"],"chemical_system":"F-Fe-K","density":3.07748871138569,"density_atomic":0.06505231635497377,"volume":184.4669132843646,"volume_molar":9.257380978009648,"formula_full":"K2 Fe2 F8","formula_reduced":"KFeF4","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":63},{"id":"jvasp-40097","created_at":"2022-09-04T14:37:49.593206Z","updated_at":"2022-09-04T14:37:49.593233Z","structure_string":"Ac1 Mg1 Hg2\n1.0\n0.000000 3.803007 3.803007\n3.803007 0.000000 3.803007\n3.803007 3.803007 0.000000\nAc Mg Hg\n1 1 2\ndirect\n0.250000 0.250000 0.250000 Ac\n0.750001 0.750001 0.750001 Mg\n0.000000 0.000000 0.000000 Hg\n0.500000 0.500000 0.500000 Hg\n","nsites":4,"nelements":3,"elements":["Ac","Mg","Hg"],"chemical_system":"Ac-Hg-Mg","density":9.849365625870933,"density_atomic":0.03636207190430308,"volume":110.00473269309609,"volume_molar":16.561599613599963,"formula_full":"Ac1 Mg1 Hg2","formula_reduced":"AcMgHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-41378","created_at":"2022-09-04T14:37:47.498125Z","updated_at":"2022-09-04T14:37:47.498136Z","structure_string":"Mg1 Ga1 Ag2\n1.0\n0.000000 3.268036 3.268036\n3.268036 0.000000 3.268036\n3.268036 3.268036 -0.000000\nMg Ga Ag\n1 1 2\ndirect\n0.750000 0.750000 0.750000 Mg\n0.249999 0.249999 0.249999 Ga\n0.500002 0.500002 0.500002 Ag\n0.000000 0.000000 0.000000 Ag\n","nsites":4,"nelements":3,"elements":["Mg","Ga","Ag"],"chemical_system":"Ag-Ga-Mg","density":7.368687017280635,"density_atomic":0.057301962975453195,"volume":69.80563653139606,"volume_molar":10.509484225836632,"formula_full":"Mg1 Ga1 Ag2","formula_reduced":"MgGaAg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-38494","created_at":"2022-09-04T14:37:58.485341Z","updated_at":"2022-09-04T14:37:58.485361Z","structure_string":"Pr1 Er1 Zn2\n1.0\n0.000000 3.612572 3.612572\n3.612572 -0.000000 3.612572\n3.612572 3.612572 -0.000000\nPr Er Zn\n1 1 2\ndirect\n0.749999 0.749999 0.749999 Pr\n0.250001 0.250001 0.250001 Er\n0.000000 0.000000 0.000000 Zn\n0.500000 0.500000 0.500000 Zn\n","nsites":4,"nelements":3,"elements":["Pr","Er","Zn"],"chemical_system":"Er-Pr-Zn","density":7.730701451511377,"density_atomic":0.04242095693380292,"volume":94.29301668611394,"volume_molar":14.196145479220174,"formula_full":"Pr1 Er1 Zn2","formula_reduced":"PrErZn2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-40313","created_at":"2022-09-04T14:37:48.951843Z","updated_at":"2022-09-04T14:37:48.951879Z","structure_string":"Li1 Ca2 In1\n1.0\n-0.000000 3.826183 3.826183\n3.826183 0.000000 3.826183\n3.826183 3.826183 0.000000\nLi Ca In\n1 2 1\ndirect\n0.749999 0.749999 0.749999 Li\n0.499999 0.499999 0.499999 Ca\n0.000000 0.000000 0.000000 Ca\n0.250001 0.250001 0.250001 In\n","nsites":4,"nelements":3,"elements":["Li","Ca","In"],"chemical_system":"Ca-In-Li","density":2.9928880470771455,"density_atomic":0.03570530788628609,"volume":112.02816154783373,"volume_molar":16.866233948126855,"formula_full":"Li1 Ca2 In1","formula_reduced":"LiCa2In","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225}]}