{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=476","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nelements&page=474","results":[{"id":"jvasp-92178","created_at":"2022-09-04T14:35:56.796960Z","updated_at":"2022-09-04T14:35:56.796986Z","structure_string":"Zr4 Sn4\n1.0\n5.812225 -0.000000 0.000000\n-0.000000 5.254411 0.000000\n0.000000 0.000000 5.958457\nZr Sn\n4 4\ndirect\n0.103541 0.250000 0.875761 Zr\n0.603540 0.250000 0.624240 Zr\n0.396459 0.750000 0.375761 Zr\n0.896459 0.750000 0.124240 Zr\n0.114554 0.250000 0.375072 Sn\n0.614554 0.250000 0.124928 Sn\n0.385445 0.750000 0.875073 Sn\n0.885445 0.750000 0.624928 Sn\n","nsites":8,"nelements":2,"elements":["Zr","Sn"],"chemical_system":"Sn-Zr","density":7.662872535328522,"density_atomic":0.043963242780715665,"volume":181.9701981471934,"volume_molar":13.698126842093624,"formula_full":"Zr4 Sn4","formula_reduced":"ZrSn","formula_anonymous":"AB","energy_above_hull":1.3797631,"spacegroup":62},{"id":"jvasp-86287","created_at":"2022-09-04T14:35:52.886838Z","updated_at":"2022-09-04T14:35:52.886864Z","structure_string":"Th2 C4\n1.0\n4.308811 0.000000 0.000000\n0.000000 4.308811 0.000000\n0.000000 0.000000 5.249054\nTh C\n2 4\ndirect\n0.500000 0.000000 0.500000 Th\n0.000000 0.500000 0.000000 Th\n0.000000 0.347874 0.500000 C\n0.000000 0.652125 0.500000 C\n0.652125 0.000000 0.000000 C\n0.347874 0.000000 0.000000 C\n","nsites":6,"nelements":2,"elements":["Th","C"],"chemical_system":"C-Th","density":8.726176403951207,"density_atomic":0.06156803886801726,"volume":97.45316093082216,"volume_molar":9.781277543872395,"formula_full":"Th2 C4","formula_reduced":"ThC2","formula_anonymous":"AB2","energy_above_hull":4.549355199999999,"spacegroup":131},{"id":"jvasp-20094","created_at":"2022-09-04T14:36:08.358806Z","updated_at":"2022-09-04T14:36:08.358835Z","structure_string":"Co6 Mo2\n1.0\n2.549520 -4.415899 0.000000\n2.549520 4.415899 -0.000000\n0.000000 0.000000 4.074733\nCo Mo\n6 2\ndirect\n0.323708 0.161854 0.749999 Co\n0.161854 0.838146 0.250000 Co\n0.161854 0.323708 0.250000 Co\n0.838146 0.676292 0.749999 Co\n0.838146 0.161854 0.749999 Co\n0.676292 0.838146 0.250000 Co\n0.333333 0.666667 0.749999 Mo\n0.666667 0.333333 0.250000 Mo\n","nsites":8,"nelements":2,"elements":["Co","Mo"],"chemical_system":"Co-Mo","density":9.872350399725898,"density_atomic":0.08719333317125523,"volume":91.75013397282692,"volume_molar":6.906652769165271,"formula_full":"Co6 Mo2","formula_reduced":"Co3Mo","formula_anonymous":"AB3","energy_above_hull":3.93114965,"spacegroup":194},{"id":"jvasp-90742","created_at":"2022-09-04T14:35:52.340893Z","updated_at":"2022-09-04T14:35:52.340921Z","structure_string":"Ca2 Hg6\n1.0\n0.000000 0.000000 -5.166216\n-3.341101 -5.785284 -0.000000\n-3.341101 5.785284 0.000000\nCa Hg\n2 6\ndirect\n0.750001 0.666651 0.333349 Ca\n0.250000 0.333349 0.666651 Ca\n0.750001 0.164821 0.329757 Hg\n0.750001 0.164766 0.835234 Hg\n0.750001 0.670243 0.835179 Hg\n0.250000 0.835179 0.670243 Hg\n0.250000 0.835234 0.164766 Hg\n0.250000 0.329757 0.164821 Hg\n","nsites":8,"nelements":2,"elements":["Ca","Hg"],"chemical_system":"Ca-Hg","density":10.673194946411659,"density_atomic":0.04005651328565262,"volume":199.71783222743522,"volume_molar":15.03411122444599,"formula_full":"Ca2 Hg6","formula_reduced":"CaHg3","formula_anonymous":"AB3","energy_above_hull":0.2137258870967741,"spacegroup":194},{"id":"jvasp-86109","created_at":"2022-09-04T14:35:47.534907Z","updated_at":"2022-09-04T14:35:47.534923Z","structure_string":"Th4 Ga2\n1.0\n5.194505 0.000000 2.921370\n2.597252 5.307701 1.460685\n-0.004543 -0.000000 6.086953\nTh Ga\n4 2\ndirect\n0.159088 0.500000 0.181823 Th\n0.840913 0.500000 0.818176 Th\n0.340912 0.818177 0.499999 Th\n0.659089 0.181823 0.499999 Th\n0.250000 -0.000000 -0.000000 Ga\n0.750001 -0.000000 -0.000000 Ga\n","nsites":6,"nelements":2,"elements":["Th","Ga"],"chemical_system":"Ga-Th","density":10.559032470131045,"density_atomic":0.03573702773049587,"volume":167.89308963375134,"volume_molar":16.85126364009579,"formula_full":"Th4 Ga2","formula_reduced":"Th2Ga","formula_anonymous":"AB2","energy_above_hull":1.7436111750000003,"spacegroup":140},{"id":"jvasp-18784","created_at":"2022-09-04T14:36:05.689076Z","updated_at":"2022-09-04T14:36:05.689103Z","structure_string":"U2 Pt6\n1.0\n2.887034 -5.000489 0.000000\n2.887034 5.000489 0.000000\n-0.000000 0.000000 5.012169\nU Pt\n2 6\ndirect\n0.333332 0.666666 0.750000 U\n0.666666 0.333332 0.250000 U\n0.330081 0.165040 0.750000 Pt\n0.165040 0.834959 0.250000 Pt\n0.165040 0.330081 0.250000 Pt\n0.834959 0.669917 0.750000 Pt\n0.834959 0.165040 0.750000 Pt\n0.669917 0.834959 0.250000 Pt\n","nsites":8,"nelements":2,"elements":["U","Pt"],"chemical_system":"Pt-U","density":18.893266990291572,"density_atomic":0.05528023880505944,"volume":144.71717512312577,"volume_molar":10.893839987262922,"formula_full":"U2 Pt6","formula_reduced":"UPt3","formula_anonymous":"AB3","energy_above_hull":3.2565125500000005,"spacegroup":194},{"id":"jvasp-94380","created_at":"2022-09-04T14:35:53.203994Z","updated_at":"2022-09-04T14:35:53.204021Z","structure_string":"Y4 Mg2\n1.0\n6.006563 -0.000000 -0.000000\n-3.003281 5.201835 0.000000\n-0.000000 0.000000 5.583546\nY Mg\n4 2\ndirect\n0.649648 0.000000 0.000000 Y\n0.350352 0.350352 0.000000 Y\n0.000000 0.649649 0.000000 Y\n0.000000 0.000000 0.500000 Y\n0.666667 0.333333 0.500000 Mg\n0.333333 0.666668 0.500000 Mg\n","nsites":6,"nelements":2,"elements":["Y","Mg"],"chemical_system":"Mg-Y","density":3.847588203439419,"density_atomic":0.034392087970417595,"volume":174.45873030916033,"volume_molar":17.5102505122107,"formula_full":"Y4 Mg2","formula_reduced":"Y2Mg","formula_anonymous":"AB2","energy_above_hull":1.656745278571429,"spacegroup":189},{"id":"jvasp-94375","created_at":"2022-09-04T14:36:05.652214Z","updated_at":"2022-09-04T14:36:05.652238Z","structure_string":"Sr4 Mg2\n1.0\n4.116028 -0.000000 0.000000\n-2.058013 3.564584 -0.000000\n-0.000000 -0.000000 17.980906\nSr Mg\n4 2\ndirect\n0.333333 0.666666 0.790798 Sr\n0.666667 0.333333 0.596503 Sr\n0.333333 0.666666 0.403497 Sr\n0.666667 0.333333 0.209202 Sr\n0.666667 0.333333 0.942656 Mg\n0.333333 0.666666 0.057345 Mg\n","nsites":6,"nelements":2,"elements":["Sr","Mg"],"chemical_system":"Mg-Sr","density":2.5120090445859495,"density_atomic":0.022743248984616257,"volume":263.8145501576514,"volume_molar":26.478805926424283,"formula_full":"Sr4 Mg2","formula_reduced":"Sr2Mg","formula_anonymous":"AB2","energy_above_hull":0.1772356862745098,"spacegroup":164},{"id":"jvasp-14880","created_at":"2022-09-04T14:35:57.462983Z","updated_at":"2022-09-04T14:35:57.463009Z","structure_string":"Na4 Hg4\n1.0\n5.276650 0.000000 0.000000\n-0.000000 5.949696 -2.450703\n-0.000000 0.028910 6.434594\nNa Hg\n4 4\ndirect\n0.250000 0.160370 0.839630 Na\n0.750000 0.839631 0.160370 Na\n0.250000 0.629487 0.370514 Na\n0.750000 0.370514 0.629486 Na\n0.750000 0.874961 0.673450 Hg\n0.250000 0.125040 0.326549 Hg\n0.250000 0.673450 0.874960 Hg\n0.750000 0.326550 0.125040 Hg\n","nsites":8,"nelements":2,"elements":["Na","Hg"],"chemical_system":"Hg-Na","density":7.337775101616515,"density_atomic":0.03952872362712618,"volume":202.38447553894918,"volume_molar":15.234847491679112,"formula_full":"Na4 Hg4","formula_reduced":"NaHg","formula_anonymous":"AB","energy_above_hull":0.3959892857142857,"spacegroup":63},{"id":"jvasp-90585","created_at":"2022-09-04T14:35:53.210561Z","updated_at":"2022-09-04T14:35:53.210593Z","structure_string":"Li2 Mg6\n1.0\n4.951814 0.000000 -0.000000\n0.000000 4.951814 0.000000\n0.000000 0.000000 7.038015\nLi Mg\n2 6\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.500000 0.500000 0.000000 Mg\n0.500000 0.000000 0.250000 Mg\n0.000000 0.500000 0.250000 Mg\n0.000000 0.000000 0.500000 Mg\n0.000000 0.500000 0.750000 Mg\n0.500000 0.000000 0.750000 Mg\n","nsites":8,"nelements":2,"elements":["Li","Mg"],"chemical_system":"Li-Mg","density":1.5367662384236782,"density_atomic":0.04635655482970002,"volume":172.57537859294297,"volume_molar":12.990915269962418,"formula_full":"Li2 Mg6","formula_reduced":"LiMg3","formula_anonymous":"AB3","energy_above_hull":0.1856642857142857,"spacegroup":225},{"id":"jvasp-97611","created_at":"2022-09-04T14:35:53.452296Z","updated_at":"2022-09-04T14:35:53.452321Z","structure_string":"Fe12 S12\n1.0\n5.855884 0.000000 0.000000\n-2.927942 5.071344 -0.000000\n-0.000000 0.000000 10.514585\nFe S\n12 12\ndirect\n0.406998 0.069141 0.114535 Fe\n0.930858 0.337857 0.385465 Fe\n0.930858 0.337857 0.114535 Fe\n0.662142 0.593001 0.114535 Fe\n0.337857 0.930858 0.885465 Fe\n0.593001 0.662142 0.885465 Fe\n0.069141 0.406998 0.885465 Fe\n0.406998 0.069141 0.385465 Fe\n0.069141 0.406998 0.614535 Fe\n0.337857 0.930858 0.614535 Fe\n0.593001 0.662142 0.614535 Fe\n0.662142 0.593001 0.385465 Fe\n0.027356 0.675997 0.750000 S\n0.333333 0.666666 0.036757 S\n0.333333 0.666666 0.463244 S\n0.666666 0.333333 0.963244 S\n0.666666 0.333333 0.536757 S\n0.675997 0.027356 0.250000 S\n0.351359 0.324002 0.250000 S\n0.972643 0.648640 0.250000 S\n0.648640 0.972643 0.750000 S\n0.324002 0.351359 0.750000 S\n0.000000 0.000000 0.500000 S\n0.000000 0.000000 0.000000 S\n","nsites":24,"nelements":2,"elements":["Fe","S"],"chemical_system":"Fe-S","density":5.609975331681966,"density_atomic":0.07686056448456724,"volume":312.25375666892137,"volume_molar":7.835150314579304,"formula_full":"Fe12 S12","formula_reduced":"FeS","formula_anonymous":"AB","energy_above_hull":1.5858677499999996,"spacegroup":190},{"id":"jvasp-18952","created_at":"2022-09-04T14:35:47.530260Z","updated_at":"2022-09-04T14:35:47.530278Z","structure_string":"Cr6 Si2\n1.0\n4.513821 -0.000000 0.000000\n0.000000 4.513821 0.000000\n0.000000 0.000000 4.513821\nCr Si\n6 2\ndirect\n0.000000 0.500000 0.250000 Cr\n0.000000 0.500000 0.750000 Cr\n0.500000 0.750000 0.000000 Cr\n0.500000 0.250000 0.000000 Cr\n0.750000 0.000000 0.500000 Cr\n0.250000 0.000000 0.500000 Cr\n0.500000 0.500000 0.500000 Si\n0.000000 0.000000 0.000000 Si\n","nsites":8,"nelements":2,"elements":["Cr","Si"],"chemical_system":"Cr-Si","density":6.6471896989023005,"density_atomic":0.08698752791335931,"volume":91.9672071606415,"volume_molar":6.922993335318288,"formula_full":"Cr6 Si2","formula_reduced":"Cr3Si","formula_anonymous":"AB3","energy_above_hull":4.2957652,"spacegroup":223}]}