{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=103","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-volume_molar&page=101","results":[{"id":"jvasp-64737","created_at":"2022-09-04T14:37:51.581626Z","updated_at":"2022-09-04T14:37:51.581659Z","structure_string":"Ba4 Cr1 Cd1\n1.0\n0.000000 5.075694 5.075694\n5.075694 0.000000 5.075694\n5.075694 5.075694 -0.000000\nBa Cr Cd\n4 1 1\ndirect\n0.125559 0.624813 0.624813 Ba\n0.624813 0.624813 0.624813 Ba\n0.624813 0.125559 0.624813 Ba\n0.624813 0.624813 0.125559 Ba\n0.000000 0.000000 0.000000 Cr\n0.250000 0.250000 0.250000 Cd\n","nsites":6,"nelements":3,"elements":["Ba","Cr","Cd"],"chemical_system":"Ba-Cd-Cr","density":4.531663896244966,"density_atomic":0.02294219461207547,"volume":261.5268548389848,"volume_molar":26.24919220600756,"formula_full":"Ba4 Cr1 Cd1","formula_reduced":"Ba4CrCd","formula_anonymous":"ABC4","energy_above_hull":0.4726268383333332,"spacegroup":216},{"id":"jvasp-64144","created_at":"2022-09-04T14:35:57.270717Z","updated_at":"2022-09-04T14:35:57.270740Z","structure_string":"Ba4 Cd1 Hg1\n1.0\n-0.000000 5.075244 5.075244\n5.075244 0.000000 5.075244\n5.075244 5.075244 0.000000\nBa Cd Hg\n4 1 1\ndirect\n0.124623 0.625126 0.625126 Ba\n0.625126 0.625126 0.625126 Ba\n0.625126 0.124623 0.625126 Ba\n0.625126 0.625126 0.124623 Ba\n0.250000 0.250000 0.250000 Cd\n0.000000 0.000000 0.000000 Hg\n","nsites":6,"nelements":3,"elements":["Ba","Cd","Hg"],"chemical_system":"Ba-Cd-Hg","density":5.476602765095463,"density_atomic":0.022948297709573424,"volume":261.4573017979002,"volume_molar":26.242211235945934,"formula_full":"Ba4 Cd1 Hg1","formula_reduced":"Ba4CdHg","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-105711","created_at":"2022-09-04T14:35:48.904383Z","updated_at":"2022-09-04T14:35:48.904416Z","structure_string":"Ba1 Yb3\n1.0\n5.062385 -0.096004 -4.548884\n-1.069384 4.949078 -4.548884\n0.078990 0.096004 6.805428\nYb Ba\n3 1\ndirect\n0.750000 0.250000 0.500001 Yb\n0.250000 0.750000 0.500001 Yb\n0.500000 0.500001 0.000001 Yb\n0.000000 0.000000 0.000000 Ba\n","nsites":4,"nelements":2,"elements":["Yb","Ba"],"chemical_system":"Ba-Yb","density":6.25404831358421,"density_atomic":0.02294945930273742,"volume":174.29604537667163,"volume_molar":26.240882979241594,"formula_full":"Ba1 Yb3","formula_reduced":"BaYb3","formula_anonymous":"AB3","energy_above_hull":0.0057725,"spacegroup":139},{"id":"jvasp-64709","created_at":"2022-09-04T14:36:16.891130Z","updated_at":"2022-09-04T14:36:16.891149Z","structure_string":"Ba4 Be1 Br1\n1.0\n-0.000000 5.074924 5.074924\n5.074924 0.000000 5.074924\n5.074924 5.074924 0.000000\nBa Be Br\n4 1 1\ndirect\n0.125054 0.624981 0.624981 Ba\n0.624981 0.624981 0.624981 Ba\n0.624981 0.125054 0.624981 Ba\n0.624981 0.624981 0.125054 Ba\n0.250000 0.250000 0.250000 Be\n0.000000 0.000000 0.000000 Br\n","nsites":6,"nelements":3,"elements":["Ba","Be","Br"],"chemical_system":"Ba-Be-Br","density":4.054186551975953,"density_atomic":0.02295263900708999,"volume":261.40784936087834,"volume_molar":26.237247743668092,"formula_full":"Ba4 Be1 Br1","formula_reduced":"Ba4BeBr","formula_anonymous":"ABC4","energy_above_hull":0.2131773474999999,"spacegroup":216},{"id":"jvasp-1267","created_at":"2022-09-04T14:36:58.972918Z","updated_at":"2022-09-04T14:36:58.972937Z","structure_string":"Ba1 Te1\n1.0\n4.309558 0.000000 2.488124\n1.436519 4.063090 2.488124\n0.000000 0.000000 4.976248\nBa Te\n1 1\ndirect\n0.000000 0.000000 0.000000 Ba\n0.500000 0.500000 0.499999 Te\n","nsites":2,"nelements":2,"elements":["Ba","Te"],"chemical_system":"Ba-Te","density":5.048753074968213,"density_atomic":0.0229529656776761,"volume":87.13470965301823,"volume_molar":26.236874330610327,"formula_full":"Ba1 Te1","formula_reduced":"BaTe","formula_anonymous":"AB","energy_above_hull":0.0121299999999999,"spacegroup":225},{"id":"jvasp-50956","created_at":"2022-09-04T14:36:47.138392Z","updated_at":"2022-09-04T14:36:47.138416Z","structure_string":"Ba2 Sr2 I8\n1.0\n-1.812590 0.000000 8.475581\n3.242012 -7.427318 4.254470\n3.242012 7.427318 4.254470\nBa Sr I\n2 2 8\ndirect\n0.750000 0.233183 0.266817 Ba\n0.250000 0.766817 0.733182 Ba\n0.250000 0.381739 0.118261 Sr\n0.750000 0.618260 0.881739 Sr\n0.257212 0.997563 0.119907 I\n0.930508 0.763364 0.126797 I\n0.430508 0.626797 0.263364 I\n0.242789 0.380092 0.502437 I\n0.757212 0.619907 0.497563 I\n0.569492 0.373202 0.736635 I\n0.069493 0.236635 0.873202 I\n0.742789 0.002437 0.880093 I\n","nsites":12,"nelements":3,"elements":["Ba","Sr","I"],"chemical_system":"Ba-I-Sr","density":4.654247997897843,"density_atomic":0.02295649492640848,"volume":522.7278832621591,"volume_molar":26.232840768179752,"formula_full":"Ba2 Sr2 I8","formula_reduced":"BaSrI4","formula_anonymous":"ABC4","energy_above_hull":0.0012783333333333,"spacegroup":15},{"id":"jvasp-115839","created_at":"2022-09-04T14:38:39.645715Z","updated_at":"2022-09-04T14:38:39.645736Z","structure_string":"Rb1 Ag1 Se1\n1.0\n5.710068 2.886240 0.000000\n2.173164 6.017084 0.000000\n0.000000 0.000000 4.651527\nRb Ag Se\n1 1 1\ndirect\n-0.194120 0.119018 0.000000 Rb\n0.529035 -0.158030 0.000000 Ag\n0.094863 0.407866 0.000000 Se\n","nsites":3,"nelements":3,"elements":["Rb","Ag","Se"],"chemical_system":"Ag-Rb-Se","density":3.4610651770442264,"density_atomic":0.022963637015855052,"volume":130.6413264557646,"volume_molar":26.224681899657547,"formula_full":"Rb1 Ag1 Se1","formula_reduced":"RbAgSe","formula_anonymous":"ABC","energy_above_hull":0.1464651044444446,"spacegroup":38},{"id":"jvasp-64840","created_at":"2022-09-04T14:36:14.563720Z","updated_at":"2022-09-04T14:36:14.563738Z","structure_string":"Ba4 Sc1 Cu1\n1.0\n0.000000 5.073649 5.073649\n5.073649 -0.000000 5.073649\n5.073649 5.073649 -0.000000\nBa Sc Cu\n4 1 1\ndirect\n0.125807 0.624731 0.624731 Ba\n0.624731 0.624731 0.624731 Ba\n0.624731 0.125807 0.624731 Ba\n0.624731 0.624731 0.125807 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Cu\n","nsites":6,"nelements":3,"elements":["Ba","Sc","Cu"],"chemical_system":"Ba-Cu-Sc","density":4.181751852822342,"density_atomic":0.022969947241953094,"volume":261.2108742261887,"volume_molar":26.21747754387941,"formula_full":"Ba4 Sc1 Cu1","formula_reduced":"Ba4ScCu","formula_anonymous":"ABC4","energy_above_hull":0.3507049299999998,"spacegroup":216},{"id":"jvasp-64148","created_at":"2022-09-04T14:36:00.238903Z","updated_at":"2022-09-04T14:36:00.238940Z","structure_string":"Ba4 Sc1 Pb1\n1.0\n0.000000 5.073176 5.073176\n5.073176 0.000000 5.073176\n5.073176 5.073176 0.000000\nBa Sc Pb\n4 1 1\ndirect\n0.127034 0.624322 0.624322 Ba\n0.624322 0.624322 0.624322 Ba\n0.624322 0.127034 0.624322 Ba\n0.624322 0.624322 0.127034 Ba\n0.000000 0.000000 0.000000 Sc\n0.250000 0.250000 0.250000 Pb\n","nsites":6,"nelements":3,"elements":["Ba","Sc","Pb"],"chemical_system":"Ba-Pb-Sc","density":5.096397405768271,"density_atomic":0.022976372683171986,"volume":261.1378254842824,"volume_molar":26.210145713777734,"formula_full":"Ba4 Sc1 Pb1","formula_reduced":"Ba4ScPb","formula_anonymous":"ABC4","energy_above_hull":0.4109949916666665,"spacegroup":216},{"id":"jvasp-64862","created_at":"2022-09-04T14:35:44.503988Z","updated_at":"2022-09-04T14:35:44.504018Z","structure_string":"Ba4 Tl1 Zn1\n1.0\n0.000000 5.073173 5.073173\n5.073173 -0.000000 5.073173\n5.073173 5.073173 0.000000\nBa Tl Zn\n4 1 1\ndirect\n0.126026 0.624658 0.624658 Ba\n0.624658 0.624658 0.624658 Ba\n0.624658 0.126026 0.624658 Ba\n0.624658 0.624658 0.126026 Ba\n0.250000 0.250000 0.250000 Tl\n0.000000 0.000000 0.000000 Zn\n","nsites":6,"nelements":3,"elements":["Ba","Tl","Zn"],"chemical_system":"Ba-Tl-Zn","density":5.20855398120386,"density_atomic":0.022976413444146717,"volume":261.1373622164912,"volume_molar":26.210099216046935,"formula_full":"Ba4 Tl1 Zn1","formula_reduced":"Ba4TlZn","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-99677","created_at":"2022-09-04T14:36:34.781424Z","updated_at":"2022-09-04T14:36:34.781450Z","structure_string":"K2 Tl1 Ga1 I6\n1.0\n7.366669 -0.000000 4.253148\n2.455556 6.945361 4.253148\n-0.000000 -0.000000 8.506296\nK Tl Ga I\n2 1 1 6\ndirect\n0.750001 0.750000 0.750001 K\n0.250000 0.250000 0.250000 K\n0.500000 0.500000 0.500000 Tl\n0.000000 0.000000 0.000000 Ga\n0.766742 0.233258 0.233259 I\n0.233259 0.233258 0.766742 I\n0.233259 0.766741 0.766742 I\n0.233259 0.766741 0.233259 I\n0.766742 0.233258 0.766742 I\n0.766742 0.766741 0.233259 I\n","nsites":10,"nelements":4,"elements":["K","Tl","Ga","I"],"chemical_system":"Ga-I-K-Tl","density":4.2493493281083925,"density_atomic":0.022977010796769958,"volume":435.2176220157311,"volume_molar":26.209417810112075,"formula_full":"K2 Tl1 Ga1 I6","formula_reduced":"K2TlGaI6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-64752","created_at":"2022-09-04T14:36:04.597932Z","updated_at":"2022-09-04T14:36:04.597953Z","structure_string":"Ba4 Mo1 Br1\n1.0\n0.000000 5.072560 5.072560\n5.072560 0.000000 5.072560\n5.072560 5.072560 0.000000\nBa Mo Br\n4 1 1\ndirect\n0.123762 0.625413 0.625413 Ba\n0.625413 0.625413 0.625413 Ba\n0.625413 0.123762 0.625413 Ba\n0.625413 0.625413 0.123762 Ba\n0.000000 0.000000 0.000000 Mo\n0.250000 0.250000 0.250000 Br\n","nsites":6,"nelements":3,"elements":["Ba","Mo","Br"],"chemical_system":"Ba-Br-Mo","density":4.612820687319478,"density_atomic":0.02298474429301252,"volume":261.0427126580665,"volume_molar":26.200599333318504,"formula_full":"Ba4 Mo1 Br1","formula_reduced":"Ba4MoBr","formula_anonymous":"ABC4","energy_above_hull":1.0338673141666663,"spacegroup":216}]}