{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=volume_molar&page=4338","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=volume_molar&page=4336","results":[{"id":"jvasp-66503","created_at":"2022-09-04T14:36:05.097115Z","updated_at":"2022-09-04T14:36:05.097143Z","structure_string":"Ba1 Ti1 Cd1\n1.0\n0.000000 3.756835 3.756835\n3.756835 0.000000 3.756835\n3.756835 3.756835 -0.000000\nBa Ti Cd\n1 1 1\ndirect\n0.749999 0.749999 0.749999 Ba\n0.499999 0.499999 0.499999 Ti\n0.000000 0.000000 0.000000 Cd\n","nsites":3,"nelements":3,"elements":["Ba","Ti","Cd"],"chemical_system":"Ba-Cd-Ti","density":4.660075590194785,"density_atomic":0.02828947547866258,"volume":106.04650490118698,"volume_molar":21.28756598736593,"formula_full":"Ba1 Ti1 Cd1","formula_reduced":"BaTiCd","formula_anonymous":"ABC","energy_above_hull":0.8722146844444443,"spacegroup":216},{"id":"jvasp-105002","created_at":"2022-09-04T14:36:46.099280Z","updated_at":"2022-09-04T14:36:46.099306Z","structure_string":"K2 Tl1 Ga1 Br6\n1.0\n6.873948 -0.000000 3.968676\n2.291316 6.480820 3.968676\n-0.000000 -0.000000 7.937351\nK Tl Ga Br\n2 1 1 6\ndirect\n0.750001 0.750000 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Ga\n0.771855 0.228145 0.228146 Br\n0.228146 0.228145 0.771855 Br\n0.228146 0.771855 0.771855 Br\n0.228146 0.771855 0.228146 Br\n0.771855 0.228145 0.771855 Br\n0.771855 0.771855 0.228146 Br\n","nsites":10,"nelements":4,"elements":["K","Tl","Ga","Br"],"chemical_system":"Br-Ga-K-Tl","density":3.905872456489797,"density_atomic":0.028280573505218044,"volume":353.59961841491304,"volume_molar":21.294266747768944,"formula_full":"K2 Tl1 Ga1 Br6","formula_reduced":"K2TlGaBr6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-3819","created_at":"2022-09-04T14:35:57.265605Z","updated_at":"2022-09-04T14:35:57.265627Z","structure_string":"K4 Ag2 Bi2\n1.0\n6.383234 0.000000 0.000000\n0.000000 6.569498 -1.543942\n0.000000 -0.011038 6.748477\nK Ag Bi\n4 2 2\ndirect\n0.249943 0.670702 0.019167 K\n0.749943 0.329298 0.980834 K\n0.250057 0.019166 0.670702 K\n0.750057 0.980834 0.329298 K\n0.000000 0.500045 0.499955 Ag\n0.500000 0.499955 0.500046 Ag\n0.250000 0.223213 0.223213 Bi\n0.750000 0.776787 0.776787 Bi\n","nsites":8,"nelements":3,"elements":["K","Ag","Bi"],"chemical_system":"Ag-Bi-K","density":4.637822627820612,"density_atomic":0.028279924114304588,"volume":282.88619048851797,"volume_molar":21.29475572727535,"formula_full":"K4 Ag2 Bi2","formula_reduced":"K2AgBi","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":63},{"id":"jvasp-90600","created_at":"2022-09-04T14:36:12.644138Z","updated_at":"2022-09-04T14:36:12.644149Z","structure_string":"Ca6 Mg2\n1.0\n5.199041 0.000000 0.000000\n0.000000 5.199041 0.000000\n-0.000000 0.000000 10.466397\nCa Mg\n6 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.000000 0.500000 0.750000 Ca\n0.500000 0.000000 0.750000 Ca\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.250000 Ca\n0.000000 0.500000 0.250000 Ca\n0.500000 0.500000 0.500000 Mg\n0.000000 0.000000 0.000000 Mg\n","nsites":8,"nelements":2,"elements":["Ca","Mg"],"chemical_system":"Ca-Mg","density":1.6967601283874854,"density_atomic":0.028277844270781654,"volume":282.90699684862733,"volume_molar":21.29632196264138,"formula_full":"Ca6 Mg2","formula_reduced":"Ca3Mg","formula_anonymous":"AB3","energy_above_hull":0.0046299999999999,"spacegroup":139},{"id":"jvasp-80619","created_at":"2022-09-04T14:37:18.317842Z","updated_at":"2022-09-04T14:37:18.317869Z","structure_string":"K1 Tl1 Hg2\n1.0\n-11.222421 0.000000 -6.479268\n-7.228802 -1.586811 -0.437884\n-5.402377 3.579096 -3.601343\nK Tl Hg\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 -0.000000 -0.000000 Tl\n0.736538 -0.000001 -0.000000 Hg\n0.263462 -0.000000 -0.000000 Hg\n","nsites":4,"nelements":3,"elements":["K","Tl","Hg"],"chemical_system":"Hg-K-Tl","density":7.567468793493846,"density_atomic":0.028276765538432034,"volume":141.4588947439355,"volume_molar":21.297134397550092,"formula_full":"K1 Tl1 Hg2","formula_reduced":"KTlHg2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":71},{"id":"jvasp-10991","created_at":"2022-09-04T14:37:17.598921Z","updated_at":"2022-09-04T14:37:17.598941Z","structure_string":"K4 Zn2 Te4\n1.0\n6.372968 -0.000000 -2.789869\n-1.342740 6.428815 -3.067255\n-0.020552 0.025376 8.626953\nK Zn Te\n4 2 4\ndirect\n0.859352 0.175720 0.718702 K\n0.140648 0.824279 0.281298 K\n0.640649 0.457017 0.281298 K\n0.359352 0.542983 0.718702 K\n0.250000 0.000000 -0.000000 Zn\n0.750000 0.000000 -0.000000 Zn\n0.608804 0.911048 0.217607 Te\n0.391196 0.088952 0.782393 Te\n0.891197 0.693441 0.782393 Te\n0.108804 0.306558 0.217607 Te\n","nsites":10,"nelements":3,"elements":["K","Zn","Te"],"chemical_system":"K-Te-Zn","density":3.7448717961381166,"density_atomic":0.02827460934887988,"volume":353.6742055959177,"volume_molar":21.29875849279796,"formula_full":"K4 Zn2 Te4","formula_reduced":"K2ZnTe2","formula_anonymous":"AB2C2","energy_above_hull":0.0,"spacegroup":72},{"id":"jvasp-93312","created_at":"2022-09-04T14:36:32.331159Z","updated_at":"2022-09-04T14:36:32.331183Z","structure_string":"Ca4 Mg2\n1.0\n3.777466 0.000000 -0.000000\n-1.888733 3.271381 -0.000000\n-0.000000 -0.000000 17.175212\nCa Mg\n4 2\ndirect\n0.666668 0.333333 0.000000 Ca\n0.000000 0.000000 0.814412 Ca\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.185588 Ca\n0.666668 0.333333 0.657468 Mg\n0.666668 0.333333 0.342532 Mg\n","nsites":6,"nelements":2,"elements":["Ca","Mg"],"chemical_system":"Ca-Mg","density":1.6345547599667438,"density_atomic":0.028269456106631525,"volume":212.24320614334366,"volume_molar":21.302641045815204,"formula_full":"Ca4 Mg2","formula_reduced":"Ca2Mg","formula_anonymous":"AB2","energy_above_hull":0.0953054999999999,"spacegroup":187},{"id":"jvasp-66115","created_at":"2022-09-04T14:36:09.240274Z","updated_at":"2022-09-04T14:36:09.240298Z","structure_string":"Ba4 V1 Ir1\n1.0\n-0.000000 4.734707 4.734707\n4.734707 0.000000 4.734707\n4.734707 4.734707 0.000000\nBa V Ir\n4 1 1\ndirect\n0.127346 0.624219 0.624219 Ba\n0.624219 0.624219 0.624219 Ba\n0.624219 0.127346 0.624219 Ba\n0.624219 0.624219 0.127346 Ba\n0.000000 0.000000 0.000000 V\n0.250000 0.250000 0.250000 Ir\n","nsites":6,"nelements":3,"elements":["Ba","V","Ir"],"chemical_system":"Ba-Ir-V","density":6.1989864709577525,"density_atomic":0.028264540477365863,"volume":212.2801184333698,"volume_molar":21.306345895920394,"formula_full":"Ba4 V1 Ir1","formula_reduced":"Ba4VIr","formula_anonymous":"ABC4","energy_above_hull":1.71008653,"spacegroup":216},{"id":"jvasp-113493","created_at":"2022-09-04T14:38:49.538837Z","updated_at":"2022-09-04T14:38:49.538864Z","structure_string":"Rb2 Cl2\n1.0\n4.637368 -0.000000 -0.000000\n0.000000 4.637368 -0.000000\n0.000000 0.000000 6.581045\nRb Cl\n2 2\ndirect\n0.000000 0.000000 0.250016 Rb\n0.500000 0.500000 0.749984 Rb\n0.000000 0.000000 0.749988 Cl\n0.500000 0.500000 0.250011 Cl\n","nsites":4,"nelements":2,"elements":["Rb","Cl"],"chemical_system":"Cl-Rb","density":2.837540851792021,"density_atomic":0.028263244086455138,"volume":141.5265702608059,"volume_molar":21.307323184765078,"formula_full":"Rb2 Cl2","formula_reduced":"RbCl","formula_anonymous":"AB","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-1999","created_at":"2022-09-04T14:35:53.117567Z","updated_at":"2022-09-04T14:35:53.117587Z","structure_string":"Rb1 Cl1\n1.0\n4.020784 0.000000 2.321401\n1.340261 3.790831 2.321401\n0.000000 0.000000 4.642802\nRb Cl\n1 1\ndirect\n0.000000 0.000000 0.000000 Rb\n0.499999 0.500000 0.500000 Cl\n","nsites":2,"nelements":2,"elements":["Rb","Cl"],"chemical_system":"Cl-Rb","density":2.8374275412251753,"density_atomic":0.028262115459811287,"volume":70.76611100977203,"volume_molar":21.308174076931643,"formula_full":"Rb1 Cl1","formula_reduced":"RbCl","formula_anonymous":"AB","energy_above_hull":0.0098,"spacegroup":225},{"id":"jvasp-103162","created_at":"2022-09-04T14:36:44.316672Z","updated_at":"2022-09-04T14:36:44.316693Z","structure_string":"K2 Rb1 Er1 Cl6\n1.0\n6.875513 0.000000 3.969579\n2.291838 6.482295 3.969579\n-0.000000 0.000000 7.939159\nK Rb Er Cl\n2 1 1 6\ndirect\n0.750000 0.750001 0.750000 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Rb\n0.000000 0.000000 0.000000 Er\n0.769338 0.230662 0.230662 Cl\n0.230661 0.230662 0.769339 Cl\n0.230661 0.769339 0.769339 Cl\n0.230661 0.769339 0.230661 Cl\n0.769338 0.230662 0.769339 Cl\n0.769338 0.769339 0.230661 Cl\n","nsites":10,"nelements":4,"elements":["K","Rb","Er","Cl"],"chemical_system":"Cl-Er-K-Rb","density":2.551251194521936,"density_atomic":0.028261265262061918,"volume":353.84119951006073,"volume_molar":21.308815101368285,"formula_full":"K2 Rb1 Er1 Cl6","formula_reduced":"K2RbErCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-122618","created_at":"2022-09-04T14:38:54.976120Z","updated_at":"2022-09-04T14:38:54.976157Z","structure_string":"Ti1 Sn7\n1.0\n6.566046 -0.000000 -0.000000\n-0.000000 6.566046 0.000000\n0.000000 -0.000000 6.566046\nTi Sn\n1 7\ndirect\n0.000000 0.000000 0.500000 Ti\n0.242494 0.242494 0.742495 Sn\n0.000000 0.500000 0.000000 Sn\n0.242494 0.757506 0.257506 Sn\n0.500000 0.000000 0.000000 Sn\n0.757506 0.242494 0.257506 Sn\n0.500000 0.500000 0.500000 Sn\n0.757506 0.757506 0.742495 Sn\n","nsites":8,"nelements":2,"elements":["Ti","Sn"],"chemical_system":"Sn-Ti","density":5.155201765822699,"density_atomic":0.028260394763273248,"volume":283.08167904280907,"volume_molar":21.30947147216173,"formula_full":"Ti1 Sn7","formula_reduced":"TiSn7","formula_anonymous":"AB7","energy_above_hull":1.0080837791666668,"spacegroup":215}]}