{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=49","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=energy_above_hull&page=47","results":[{"id":"jvasp-64780","created_at":"2022-09-04T14:35:42.223568Z","updated_at":"2022-09-04T14:35:42.223589Z","structure_string":"Ba4 Ca1 Sn1\n1.0\n0.000000 5.160848 5.160848\n5.160848 0.000000 5.160848\n5.160848 5.160848 0.000000\nBa Ca Sn\n4 1 1\ndirect\n0.119196 0.626935 0.626935 Ba\n0.626935 0.626935 0.626935 Ba\n0.626935 0.119196 0.626935 Ba\n0.626935 0.626935 0.119196 Ba\n0.250000 0.250000 0.250000 Ca\n0.000000 0.000000 0.000000 Sn\n","nsites":6,"nelements":3,"elements":["Ba","Ca","Sn"],"chemical_system":"Ba-Ca-Sn","density":4.2770865470680395,"density_atomic":0.02182519085382257,"volume":274.9116853174794,"volume_molar":27.592614425844772,"formula_full":"Ba4 Ca1 Sn1","formula_reduced":"Ba4CaSn","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-97378","created_at":"2022-09-04T14:35:41.460458Z","updated_at":"2022-09-04T14:35:41.460491Z","structure_string":"Rb8 Pd4 I24\n1.0\n7.843872 0.000000 0.000000\n0.000000 12.306037 0.000000\n0.000000 0.000000 14.515626\nRb Pd I\n8 4 24\ndirect\n0.287652 0.007057 0.860461 Rb\n0.787652 0.492943 0.639540 Rb\n0.712348 0.507057 0.139539 Rb\n0.212348 0.992944 0.360461 Rb\n0.712348 0.992944 0.139539 Rb\n0.212348 0.507057 0.360461 Rb\n0.287652 0.492943 0.860461 Rb\n0.787652 0.007057 0.639540 Rb\n0.732724 0.750000 0.398702 Pd\n0.232724 0.750000 0.101298 Pd\n0.267276 0.250000 0.601299 Pd\n0.767276 0.250000 0.898702 Pd\n0.040616 0.250000 0.789568 I\n0.227940 0.531261 0.106261 I\n0.727940 0.968739 0.393739 I\n0.227940 0.968739 0.106261 I\n0.727940 0.531261 0.393739 I\n0.772059 0.468739 0.893739 I\n0.272060 0.031261 0.606261 I\n0.459383 0.750000 0.289568 I\n0.959383 0.750000 0.210432 I\n0.540616 0.250000 0.710432 I\n0.034815 0.750000 0.491618 I\n0.985436 0.250000 0.282738 I\n0.965185 0.250000 0.508382 I\n0.465185 0.250000 0.991618 I\n0.014563 0.750000 0.717263 I\n0.514563 0.750000 0.782738 I\n0.272060 0.468739 0.606261 I\n0.485437 0.250000 0.217262 I\n0.044700 0.750000 0.919285 I\n0.544699 0.750000 0.580715 I\n0.955300 0.250000 0.080715 I\n0.455300 0.250000 0.419285 I\n0.534815 0.750000 0.008382 I\n0.772059 0.031261 0.893739 I\n","nsites":36,"nelements":3,"elements":["Rb","Pd","I"],"chemical_system":"I-Pd-Rb","density":4.924353202910906,"density_atomic":0.02569318927742448,"volume":1401.1495268760457,"volume_molar":23.438665768485972,"formula_full":"Rb8 Pd4 I24","formula_reduced":"Rb2PdI6","formula_anonymous":"AB2C6","energy_above_hull":0.0,"spacegroup":62},{"id":"jvasp-65318","created_at":"2022-09-04T14:35:41.045616Z","updated_at":"2022-09-04T14:35:41.045639Z","structure_string":"La1 Be1 Cd4\n1.0\n0.000000 4.148810 4.148810\n4.148810 0.000000 4.148810\n4.148810 4.148810 0.000000\nLa Be Cd\n1 1 4\ndirect\n0.250000 0.250000 0.250000 La\n0.000000 0.000000 0.000000 Be\n0.124160 0.625280 0.625280 Cd\n0.625280 0.625280 0.625280 Cd\n0.625280 0.124160 0.625280 Cd\n0.625280 0.625280 0.124160 Cd\n","nsites":6,"nelements":3,"elements":["La","Be","Cd"],"chemical_system":"Be-Cd-La","density":6.947542023574452,"density_atomic":0.04200980020361743,"volume":142.82381660751972,"volume_molar":14.335085458181823,"formula_full":"La1 Be1 Cd4","formula_reduced":"LaBeCd4","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":216},{"id":"jvasp-86915","created_at":"2022-09-04T14:35:49.526625Z","updated_at":"2022-09-04T14:35:49.526655Z","structure_string":"Ba2 Cu2 Sn4\n1.0\n4.707330 0.000000 -0.000000\n0.000000 4.716230 -1.150124\n-0.000000 -0.045302 10.059043\nBa Cu Sn\n2 2 4\ndirect\n0.250000 0.607796 0.215591 Ba\n0.750000 0.392205 0.784409 Ba\n0.750000 0.179454 0.358908 Cu\n0.250000 0.820547 0.641092 Cu\n0.250000 0.956632 0.913264 Sn\n0.750000 0.043369 0.086736 Sn\n0.750000 0.750320 0.500640 Sn\n0.250000 0.249680 0.499360 Sn\n","nsites":8,"nelements":3,"elements":["Ba","Cu","Sn"],"chemical_system":"Ba-Cu-Sn","density":6.525211272076384,"density_atomic":0.03586253103085143,"volume":223.07404887618912,"volume_molar":16.792291527944133,"formula_full":"Ba2 Cu2 Sn4","formula_reduced":"BaCuSn2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":63},{"id":"jvasp-69125","created_at":"2022-09-04T14:35:52.205737Z","updated_at":"2022-09-04T14:35:52.205757Z","structure_string":"Ba2 Cd1 Br1\n1.0\n0.000000 4.215058 4.215058\n4.215058 0.000000 4.215058\n4.215058 4.215058 0.000000\nBa Cd Br\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.500000 0.500000 0.500000 Cd\n0.000000 0.000000 0.000000 Br\n","nsites":4,"nelements":3,"elements":["Ba","Cd","Br"],"chemical_system":"Ba-Br-Cd","density":5.177218417998285,"density_atomic":0.026706644825866054,"volume":149.77545948137595,"volume_molar":22.549222484763064,"formula_full":"Ba2 Cd1 Br1","formula_reduced":"Ba2CdBr","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-94149","created_at":"2022-09-04T14:35:59.150079Z","updated_at":"2022-09-04T14:35:59.150103Z","structure_string":"Mg6 Ga1 Co1\n1.0\n6.054808 -0.062477 0.000000\n-3.081511 5.337334 0.000000\n0.000000 0.000000 4.728174\nMg Ga Co\n6 1 1\ndirect\n0.670009 0.333031 0.250000 Mg\n0.670009 0.836976 0.250000 Mg\n0.321476 0.172515 0.749999 Mg\n0.321476 0.648960 0.749999 Mg\n0.849560 0.174779 0.749999 Mg\n0.837255 0.668627 0.749999 Mg\n0.166051 0.833024 0.250000 Ga\n0.164164 0.332081 0.250000 Co\n","nsites":8,"nelements":3,"elements":["Mg","Ga","Co"],"chemical_system":"Co-Ga-Mg","density":3.000864697533426,"density_atomic":0.05267042188844881,"volume":151.88790431455584,"volume_molar":11.433629244045832,"formula_full":"Mg6 Ga1 Co1","formula_reduced":"Mg6GaCo","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":38},{"id":"jvasp-86695","created_at":"2022-09-04T14:35:41.048650Z","updated_at":"2022-09-04T14:35:41.048673Z","structure_string":"Rb2 Hg2 Pd1 Cl8\n1.0\n6.368097 0.039047 1.932409\n2.754388 5.741736 1.932409\n-0.037039 -0.023470 9.834079\nRb Hg Pd Cl\n2 2 1 8\ndirect\n0.397295 0.397295 0.829109 Rb\n0.602705 0.602706 0.170891 Rb\n0.866074 0.866075 0.400908 Hg\n0.133926 0.133926 0.599092 Hg\n0.000000 0.000000 0.000000 Pd\n0.085111 0.085111 0.305976 Cl\n0.106719 0.623961 0.134386 Cl\n0.647880 0.647881 0.503489 Cl\n0.376039 0.893282 0.865614 Cl\n0.352119 0.352120 0.496511 Cl\n0.623961 0.106720 0.134386 Cl\n0.893281 0.376040 0.865614 Cl\n0.914889 0.914890 0.694024 Cl\n","nsites":13,"nelements":4,"elements":["Rb","Hg","Pd","Cl"],"chemical_system":"Cl-Hg-Pd-Rb","density":4.449349676303782,"density_atomic":0.03620292627704166,"volume":359.08699480583266,"volume_molar":16.634403290816255,"formula_full":"Rb2 Hg2 Pd1 Cl8","formula_reduced":"Rb2Hg2PdCl8","formula_anonymous":"AB2C2D8","energy_above_hull":0.0,"spacegroup":12},{"id":"jvasp-97366","created_at":"2022-09-04T14:35:53.025500Z","updated_at":"2022-09-04T14:35:53.025530Z","structure_string":"K4 Tl4 Br16\n1.0\n7.972900 -0.000000 0.000000\n0.000000 10.268482 0.000000\n0.000000 0.000000 10.444753\nK Tl Br\n4 4 16\ndirect\n0.177332 0.250000 0.750000 K\n0.322668 0.750000 0.750000 K\n0.822668 0.750000 0.250000 K\n0.677333 0.250000 0.250000 K\n0.750000 0.000000 0.825567 Tl\n0.750000 0.500000 0.674433 Tl\n0.250000 0.500000 0.325567 Tl\n0.250000 0.000000 0.174433 Tl\n0.639355 0.801551 0.961116 Br\n0.639355 0.698449 0.538884 Br\n0.860645 0.301551 0.538884 Br\n0.139355 0.698449 0.461116 Br\n0.989795 0.045944 0.325125 Br\n0.989795 0.454056 0.174874 Br\n0.510205 0.545944 0.174874 Br\n0.510205 0.954056 0.325125 Br\n0.010205 0.954056 0.674874 Br\n0.010205 0.545944 0.825125 Br\n0.489795 0.454056 0.825125 Br\n0.489795 0.045944 0.674874 Br\n0.360645 0.301551 0.461116 Br\n0.360645 0.198449 0.038884 Br\n0.139355 0.801551 0.038884 Br\n0.860645 0.198449 0.961116 Br\n","nsites":24,"nelements":3,"elements":["K","Tl","Br"],"chemical_system":"Br-K-Tl","density":4.373932009058471,"density_atomic":0.02806664518796287,"volume":855.107542753027,"volume_molar":21.456574947485194,"formula_full":"K4 Tl4 Br16","formula_reduced":"KTlBr4","formula_anonymous":"ABC4","energy_above_hull":0.0,"spacegroup":52},{"id":"jvasp-65530","created_at":"2022-09-04T14:35:42.318327Z","updated_at":"2022-09-04T14:35:42.318358Z","structure_string":"K1 Ba1 Cd2\n1.0\n4.202187 -0.000000 0.000000\n0.000000 4.202187 -0.000000\n-0.000000 -0.000000 8.555293\nK Ba Cd\n1 1 2\ndirect\n0.500000 0.500000 0.000000 K\n0.500000 0.500000 0.500000 Ba\n0.000000 0.000000 0.736642 Cd\n0.000000 0.000000 0.263358 Cd\n","nsites":4,"nelements":3,"elements":["K","Ba","Cd"],"chemical_system":"Ba-Cd-K","density":4.410375662987993,"density_atomic":0.026477340090433555,"volume":151.07257701634566,"volume_molar":22.744508094209362,"formula_full":"K1 Ba1 Cd2","formula_reduced":"KBaCd2","formula_anonymous":"ABC2","energy_above_hull":0.0,"spacegroup":123},{"id":"jvasp-93194","created_at":"2022-09-04T14:35:52.819975Z","updated_at":"2022-09-04T14:35:52.819999Z","structure_string":"K1 Mg6 Nb1\n1.0\n6.358791 -1.703660 0.000000\n-4.654808 8.062364 0.000000\n0.000000 0.000000 4.523015\nK Mg Nb\n1 6 1\ndirect\n0.249965 0.374982 0.250000 K\n0.750017 0.375046 0.250000 Mg\n0.750016 0.874970 0.250000 Mg\n0.250000 0.094245 0.749999 Mg\n0.250000 0.655756 0.749999 Mg\n0.688438 0.094219 0.749999 Mg\n0.811566 0.655783 0.749999 Mg\n0.249992 0.874996 0.250000 Nb\n","nsites":8,"nelements":3,"elements":["K","Mg","Nb"],"chemical_system":"K-Mg-Nb","density":2.353704362730945,"density_atomic":0.04081373566378451,"volume":196.0124421322865,"volume_molar":14.755181465399799,"formula_full":"K1 Mg6 Nb1","formula_reduced":"KMg6Nb","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":123},{"id":"jvasp-92936","created_at":"2022-09-04T14:35:45.323234Z","updated_at":"2022-09-04T14:35:45.323252Z","structure_string":"Rb1 Mg6 Ga1\n1.0\n6.814391 0.739512 0.000000\n-2.766759 6.271191 0.000000\n0.000000 0.000000 4.880536\nRb Mg Ga\n1 6 1\ndirect\n0.122234 0.377766 0.250000 Rb\n0.200379 0.903740 0.250000 Mg\n0.596259 0.299621 0.250000 Mg\n0.691262 0.808737 0.250000 Mg\n0.399978 0.724853 0.750001 Mg\n0.775147 0.100021 0.750001 Mg\n0.861905 0.638095 0.750001 Mg\n0.352833 0.147166 0.750001 Ga\n","nsites":8,"nelements":3,"elements":["Rb","Mg","Ga"],"chemical_system":"Ga-Mg-Rb","density":2.287126172274002,"density_atomic":0.03660450241331852,"volume":218.5523493713496,"volume_molar":16.45191264178706,"formula_full":"Rb1 Mg6 Ga1","formula_reduced":"RbMg6Ga","formula_anonymous":"ABC6","energy_above_hull":0.0,"spacegroup":38},{"id":"jvasp-99415","created_at":"2022-09-04T14:36:38.819094Z","updated_at":"2022-09-04T14:36:38.819109Z","structure_string":"Rb2 Tb1 Cu1 Cl6\n1.0\n6.307670 -0.000000 3.641735\n2.102557 5.946928 3.641735\n-0.000000 -0.000000 7.283470\nTb Rb Cu Cl\n1 2 1 6\ndirect\n0.000000 0.000000 0.000000 Tb\n0.750000 0.750000 0.749999 Rb\n0.250000 0.250000 0.250000 Rb\n0.500000 0.500000 0.499999 Cu\n0.744784 0.255216 0.255215 Cl\n0.255216 0.255216 0.744783 Cl\n0.255217 0.744784 0.744783 Cl\n0.255217 0.744784 0.255215 Cl\n0.744784 0.255216 0.744783 Cl\n0.744784 0.744784 0.255215 Cl\n","nsites":10,"nelements":4,"elements":["Tb","Rb","Cu","Cl"],"chemical_system":"Cl-Cu-Rb-Tb","density":3.683929228063031,"density_atomic":0.03660159570883929,"volume":273.2121320487948,"volume_molar":16.453219165375494,"formula_full":"Rb2 Tb1 Cu1 Cl6","formula_reduced":"Rb2TbCuCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225}]}