{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=chemical_system&page=3594","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=chemical_system&page=3592","results":[{"id":"jvasp-51093","created_at":"2022-09-04T14:38:26.778340Z","updated_at":"2022-09-04T14:38:26.778362Z","structure_string":"K1 Mn1 Ru1\n1.0\n0.000000 3.227972 3.227972\n3.227972 0.000000 3.227972\n3.227972 3.227972 0.000000\nK Mn Ru\n1 1 1\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Mn\n0.250000 0.250000 0.250000 Ru\n","nsites":3,"nelements":3,"elements":["K","Mn","Ru"],"chemical_system":"K-Mn-Ru","density":4.816163458198728,"density_atomic":0.04459662387473479,"volume":67.26966616187245,"volume_molar":13.503579950166829,"formula_full":"K1 Mn1 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S\n","nsites":18,"nelements":3,"elements":["K","Mn","S"],"chemical_system":"K-Mn-S","density":2.839304519198417,"density_atomic":0.04144905828067311,"volume":434.2680086508275,"volume_molar":14.529017087001003,"formula_full":"K4 Mn6 S8","formula_reduced":"K2Mn3S4","formula_anonymous":"A2B3C4","energy_above_hull":2.334315302681992,"spacegroup":13},{"id":"jvasp-15342","created_at":"2022-09-04T14:36:59.143658Z","updated_at":"2022-09-04T14:36:59.143687Z","structure_string":"K2 Mn2 Sb2\n1.0\n4.634861 0.000000 0.000000\n0.000000 4.634861 0.000000\n0.000000 0.000000 8.133209\nK Mn Sb\n2 2 2\ndirect\n0.000000 0.500000 0.650983 K\n0.500000 0.000000 0.349017 K\n0.000000 0.000000 0.000000 Mn\n0.500000 0.500000 0.000000 Mn\n0.000000 0.500000 0.189797 Sb\n0.500000 0.000000 0.810203 Sb\n","nsites":6,"nelements":3,"elements":["K","Mn","Sb"],"chemical_system":"K-Mn-Sb","density":4.101925958909142,"density_atomic":0.034341233425689545,"volume":174.71707919237397,"volume_molar":17.536180734542388,"formula_full":"K2 Mn2 Sb2","formula_reduced":"KMnSb","formula_anonymous":"ABC","energy_above_hull":1.414517113793104,"spacegroup":129},{"id":"jvasp-87095","created_at":"2022-09-04T14:36:03.438204Z","updated_at":"2022-09-04T14:36:03.438235Z","structure_string":"K4 Mn2 Se4\n1.0\n5.960919 0.000000 -2.556911\n-1.321745 6.172864 -3.081379\n-0.035866 0.060221 8.143180\nK Mn Se\n4 2 4\ndirect\n0.145863 0.479975 0.291725 K\n0.854137 0.520024 0.708275 K\n0.354137 0.188249 0.708275 K\n0.645863 0.811750 0.291725 K\n0.250000 -0.000000 0.000000 Mn\n0.750000 -0.000000 0.000000 Mn\n0.893830 0.092212 0.787662 Se\n0.106170 0.907787 0.212337 Se\n0.606169 0.304550 0.212338 Se\n0.393831 0.695449 0.787662 Se\n","nsites":10,"nelements":3,"elements":["K","Mn","Se"],"chemical_system":"K-Mn-Se","density":3.2179795075325797,"density_atomic":0.033291215063504125,"volume":300.37954400056174,"volume_molar":18.089278953959962,"formula_full":"K4 Mn2 Se4","formula_reduced":"K2MnSe2","formula_anonymous":"AB2C2","energy_above_hull":0.9066699949425284,"spacegroup":72},{"id":"jvasp-55253","created_at":"2022-09-04T14:38:34.933511Z","updated_at":"2022-09-04T14:38:34.933534Z","structure_string":"K12 Mn2 Se8\n1.0\n5.110452 -8.851563 -0.000000\n5.110452 8.851563 0.000000\n0.000000 -0.000000 7.856003\nK Mn Se\n12 2 8\ndirect\n0.146582 0.853418 0.547116 K\n0.472838 0.527162 0.865778 K\n0.527162 0.054325 0.365778 K\n0.472838 0.945675 0.865778 K\n0.054325 0.527162 0.865778 K\n0.527162 0.472838 0.365778 K\n0.945675 0.472838 0.365778 K\n0.706837 0.853418 0.547116 K\n0.146582 0.293163 0.547116 K\n0.853418 0.706837 0.047116 K\n0.293163 0.146582 0.047116 K\n0.853418 0.146582 0.047116 K\n0.333333 0.666667 0.249895 Mn\n0.666667 0.333333 0.749895 Mn\n0.609781 0.804890 0.149140 Se\n0.333333 0.666667 0.576701 Se\n0.666667 0.333333 0.076701 Se\n0.195109 0.804890 0.149140 Se\n0.390219 0.195109 0.649139 Se\n0.804890 0.609781 0.649139 Se\n0.195109 0.390219 0.149140 Se\n0.804890 0.195109 0.649139 Se\n","nsites":22,"nelements":3,"elements":["K","Mn","Se"],"chemical_system":"K-Mn-Se","density":2.828704150007115,"density_atomic":0.030953642775969497,"volume":710.7402562996381,"volume_molar":19.455353941976803,"formula_full":"K12 Mn2 Se8","formula_reduced":"K6MnSe4","formula_anonymous":"AB4C6","energy_above_hull":0.3642635189132708,"spacegroup":186},{"id":"jvasp-98305","created_at":"2022-09-04T14:36:11.829666Z","updated_at":"2022-09-04T14:36:11.829692Z","structure_string":"K8 Mn4 Sn4 Se16\n1.0\n8.257138 -0.000000 0.000000\n-0.000000 10.635922 0.000000\n0.000000 0.000000 10.635922\nK Mn Sn Se\n8 4 4 16\ndirect\n0.750000 0.252700 0.247300 K\n0.500000 0.500000 0.500000 K\n0.000000 0.000000 0.000000 K\n0.750000 0.747300 0.752699 K\n0.250000 0.000000 0.500000 K\n0.750000 0.500000 0.000000 K\n0.250000 0.247300 0.747300 K\n0.250000 0.752699 0.252700 K\n0.000000 0.500000 0.500000 Mn\n0.500000 0.000000 0.000000 Mn\n0.750000 0.000000 0.500000 Mn\n0.250000 0.500000 0.000000 Mn\n0.750000 0.221512 0.721511 Sn\n0.750000 0.778488 0.278488 Sn\n0.250000 0.278488 0.221512 Sn\n0.250000 0.721511 0.778488 Sn\n0.395449 0.937216 0.788043 Se\n0.895450 0.437216 0.711956 Se\n0.895450 0.562784 0.288044 Se\n0.568085 0.194877 0.525304 Se\n0.604551 0.788043 0.062784 Se\n0.604551 0.211956 0.937216 Se\n0.568085 0.805123 0.474696 Se\n0.431915 0.525304 0.805123 Se\n0.931915 0.025304 0.694877 Se\n0.104551 0.711956 0.562784 Se\n0.431915 0.474696 0.194877 Se\n0.931915 0.974696 0.305123 Se\n0.104551 0.288044 0.437216 Se\n0.068085 0.305123 0.025304 Se\n0.068085 0.694877 0.974696 Se\n0.395449 0.062784 0.211956 Se\n","nsites":32,"nelements":4,"elements":["K","Mn","Sn","Se"],"chemical_system":"K-Mn-Se-Sn","density":4.036792309621858,"density_atomic":0.03425864233594607,"volume":934.0708743272007,"volume_molar":17.578457140670857,"formula_full":"K8 Mn4 Sn4 Se16","formula_reduced":"K2MnSnSe4","formula_anonymous":"ABC2D4","energy_above_hull":1.114614801005747,"spacegroup":118},{"id":"jvasp-87097","created_at":"2022-09-04T14:36:17.876629Z","updated_at":"2022-09-04T14:36:17.876658Z","structure_string":"K4 Mn2 Te4\n1.0\n6.356351 -0.000000 -2.736488\n-1.364141 6.507033 -3.168646\n-0.026534 0.057564 8.688917\nK Mn Te\n4 2 4\ndirect\n0.143189 0.465516 0.286378 K\n0.856811 0.534483 0.713622 K\n0.356811 0.179138 0.713622 K\n0.643189 0.820861 0.286377 K\n0.250000 0.000000 -0.000000 Mn\n0.750000 0.000000 -0.000000 Mn\n0.890982 0.092323 0.781963 Te\n0.109019 0.907676 0.218036 Te\n0.609018 0.310361 0.218036 Te\n0.390982 0.689638 0.781963 Te\n","nsites":10,"nelements":3,"elements":["K","Mn","Te"],"chemical_system":"K-Mn-Te","density":3.5796476542822164,"density_atomic":0.027755883141383133,"volume":360.2839783213498,"volume_molar":21.69680831023957,"formula_full":"K4 Mn2 Te4","formula_reduced":"K2MnTe2","formula_anonymous":"AB2C2","energy_above_hull":0.7430897549425284,"spacegroup":72},{"id":"jvasp-15956","created_at":"2022-09-04T14:37:57.013658Z","updated_at":"2022-09-04T14:37:57.013672Z","structure_string":"K1 Mn1 Te2\n1.0\n4.106416 0.000000 -1.189230\n-0.344404 4.091948 -1.189230\n0.015826 0.017214 7.738997\nK Mn Te\n1 1 2\ndirect\n0.000000 0.000000 0.000000 K\n0.750002 0.250000 0.500000 Mn\n0.357686 0.357684 0.715370 Te\n0.642317 0.642316 0.284630 Te\n","nsites":4,"nelements":3,"elements":["K","Mn","Te"],"chemical_system":"K-Mn-Te","density":4.453789329395832,"density_atomic":0.030719994239175288,"volume":130.208357750896,"volume_molar":19.60332646260832,"formula_full":"K1 Mn1 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5.176209 -0.037225\n0.000000 -0.108669 15.212547\nK Na Mo O\n6 2 4 16\ndirect\n0.356106 0.652697 0.084107 K\n0.643894 0.347303 0.915893 K\n0.067790 -0.000000 0.250000 K\n0.932211 -0.000000 0.750000 K\n0.703408 0.347303 0.415893 K\n0.296592 0.652697 0.584107 K\n0.000000 0.000000 0.000000 Na\n-0.000000 -0.000000 0.500000 Na\n0.364051 0.676962 0.360752 Mo\n0.635949 0.323038 0.639248 Mo\n0.687088 0.323038 0.139248 Mo\n0.312912 0.676962 0.860752 Mo\n0.620095 0.358949 0.250277 O\n0.379905 0.641051 0.749723 O\n0.389559 0.161455 0.080578 O\n0.160052 0.863000 0.874785 O\n0.261146 0.641051 0.249723 O\n0.771897 0.161455 0.580578 O\n0.297053 0.136999 0.625215 O\n0.872430 0.627609 0.087298 O\n0.702947 0.863001 0.374785 O\n0.127570 0.372391 0.912701 O\n0.228103 0.838545 0.419422 O\n0.839948 0.136999 0.125215 O\n0.610441 0.838544 0.919422 O\n0.738854 0.358949 0.750277 O\n0.244821 0.372391 0.412701 O\n0.755179 0.627609 0.587299 O\n","nsites":28,"nelements":4,"elements":["K","Na","Mo","O"],"chemical_system":"K-Mo-Na-O","density":3.2109051505944604,"density_atomic":0.05882984091845528,"volume":475.94893276715,"volume_molar":10.236540956055547,"formula_full":"K6 Na2 Mo4 O16","formula_reduced":"K3Na(MoO4)2","formula_anonymous":"AB2C3D8","energy_above_hull":2.287401628571428,"spacegroup":15},{"id":"jvasp-92275","created_at":"2022-09-04T14:35:57.832109Z","updated_at":"2022-09-04T14:35:57.832121Z","structure_string":"K1 Mo1 O3\n1.0\n0.000177 -3.940785 -0.000750\n-3.940900 -0.000178 -0.000330\n0.000456 0.001097 -3.940821\nK Mo O\n1 1 3\ndirect\n0.988022 -0.000006 0.997997 K\n0.487988 0.500004 0.497996 Mo\n0.488002 -0.000003 0.498016 O\n0.987994 0.500010 0.497982 O\n0.487986 0.499987 0.998006 O\n","nsites":5,"nelements":3,"elements":["K","Mo","O"],"chemical_system":"K-Mo-O","density":4.966173715653721,"density_atomic":0.08169681228775173,"volume":61.201898335874446,"volume_molar":7.371328931156913,"formula_full":"K1 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