{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=539","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=updated_at&page=537","results":[{"id":"jvasp-85664","created_at":"2022-09-04T14:35:58.522485Z","updated_at":"2022-09-04T14:35:58.522510Z","structure_string":"K2 H6 C4 O6\n1.0\n3.730971 0.012133 0.067720\n-0.240307 5.456405 -1.071359\n0.188542 -0.079984 9.698053\nK H C O\n2 6 4 6\ndirect\n0.880778 0.707030 0.874189 K\n0.119220 0.292971 0.125810 K\n0.016330 0.164739 0.602551 H\n0.983668 0.835262 0.397449 H\n0.158407 0.471605 0.584326 H\n0.841592 0.528396 0.415674 H\n0.439589 0.218073 0.518632 H\n0.560409 0.781928 0.481368 H\n0.754380 0.704999 0.397595 C\n0.245619 0.295002 0.602405 C\n0.495402 0.151262 0.797453 C\n0.504597 0.848739 0.202546 C\n0.662142 0.217272 0.911004 O\n0.408702 0.350146 0.738090 O\n0.591296 0.649855 0.261909 O\n0.404573 0.938740 0.735253 O\n0.595425 0.061261 0.264746 O\n0.337856 0.782730 0.088996 O\n","nsites":18,"nelements":4,"elements":["K","H","C","O"],"chemical_system":"C-H-K-O","density":1.9235703605877268,"density_atomic":0.09133917317439927,"volume":197.0676914890782,"volume_molar":6.593163207752683,"formula_full":"K2 H6 C4 O6","formula_reduced":"KH3C2O3","formula_anonymous":"AB2C3D3","energy_above_hull":3.3149231666666665,"spacegroup":2},{"id":"jvasp-96071","created_at":"2022-09-04T14:35:58.529860Z","updated_at":"2022-09-04T14:35:58.529884Z","structure_string":"Eu2 Al4 Cl16\n1.0\n6.800734 0.000000 0.000000\n0.000000 6.444818 -0.346929\n0.000000 0.285827 12.999106\nEu Al Cl\n2 4 16\ndirect\n0.175887 0.500000 0.250000 Eu\n0.824112 0.500001 0.750000 Eu\n0.258048 0.665561 0.912429 Al\n0.258048 0.334440 0.587571 Al\n0.741952 0.334440 0.087571 Al\n0.741952 0.665561 0.412429 Al\n0.845572 0.645287 0.128530 Cl\n0.154427 0.354714 0.871470 Cl\n0.154427 0.645287 0.628530 Cl\n0.491510 0.233518 0.178309 Cl\n0.491510 0.766483 0.321692 Cl\n0.508489 0.766483 0.821692 Cl\n0.508489 0.233518 0.678309 Cl\n0.001459 0.840974 0.371338 Cl\n0.998540 0.840975 0.871339 Cl\n0.660984 0.289085 0.926976 Cl\n0.660984 0.710916 0.573024 Cl\n0.339015 0.710916 0.073024 Cl\n0.339015 0.289085 0.426976 Cl\n0.845572 0.354714 0.371470 Cl\n0.001459 0.159026 0.128662 Cl\n0.998540 0.159026 0.628662 Cl\n","nsites":22,"nelements":3,"elements":["Eu","Al","Cl"],"chemical_system":"Al-Cl-Eu","density":2.850253109249881,"density_atomic":0.03856816755995973,"volume":570.4185962633006,"volume_molar":15.614277630996392,"formula_full":"Eu2 Al4 Cl16","formula_reduced":"Eu(AlCl4)2","formula_anonymous":"AB2C8","energy_above_hull":0.4725125581818182,"spacegroup":13},{"id":"jvasp-61762","created_at":"2022-09-04T14:35:58.535410Z","updated_at":"2022-09-04T14:35:58.535431Z","structure_string":"Ho1 B2 Ir3\n1.0\n4.722518 2.726436 -0.028562\n-4.722518 2.726436 -0.028562\n0.000000 0.033211 3.167530\nHo B Ir\n1 2 3\ndirect\n0.500001 0.500001 0.500001 Ho\n0.166674 0.833327 0.500001 B\n0.833327 0.166674 0.500001 B\n0.000000 0.000000 0.000000 Ir\n0.500000 0.000000 0.000000 Ir\n0.000000 0.500000 0.000000 Ir\n","nsites":6,"nelements":3,"elements":["Ho","B","Ir"],"chemical_system":"B-Ho-Ir","density":15.535383794803321,"density_atomic":0.07355020521026527,"volume":81.57693078961785,"volume_molar":8.187795999730945,"formula_full":"Ho1 B2 Ir3","formula_reduced":"HoB2Ir3","formula_anonymous":"AB2C3","energy_above_hull":4.367197338888889,"spacegroup":191},{"id":"jvasp-52816","created_at":"2022-09-04T14:35:58.539410Z","updated_at":"2022-09-04T14:35:58.539435Z","structure_string":"Nd3 Al3 Si3 N2 O12\n1.0\n8.123489 0.000000 0.000000\n-4.061744 6.832431 -0.072114\n0.000000 -0.037275 4.922671\nNd Al Si N O\n3 3 3 2 12\ndirect\n0.988293 0.408704 0.005463 Nd\n0.579590 0.591297 0.994537 Nd\n0.416388 0.000000 0.000000 Nd\n0.013429 0.777748 0.525401 Al\n0.002408 0.000000 0.000000 Al\n0.235682 0.222253 0.474599 Al\n0.333809 0.662478 0.541512 Si\n0.671332 0.337523 0.458488 Si\n0.738879 0.000000 0.500000 Si\n0.540443 0.839615 0.685207 N\n0.700828 0.160385 0.314794 N\n0.658222 0.335915 0.791930 O\n0.870476 0.764892 0.803736 O\n0.787728 0.878227 0.264688 O\n0.473317 0.316984 0.321702 O\n0.208451 0.066690 0.748582 O\n0.141761 0.933310 0.251418 O\n0.322307 0.664086 0.208070 O\n0.105584 0.235108 0.196264 O\n0.156334 0.683017 0.678298 O\n0.846397 0.547546 0.336319 O\n0.298850 0.452454 0.663682 O\n0.909501 0.121774 0.735313 O\n","nsites":23,"nelements":5,"elements":["Nd","Al","Si","N","O"],"chemical_system":"Al-N-Nd-O-Si","density":4.97144963192059,"density_atomic":0.08418677716434818,"volume":273.2020487623578,"volume_molar":7.15330953724914,"formula_full":"Nd3 Al3 Si3 N2 O12","formula_reduced":"Nd3Al3Si3(NO6)2","formula_anonymous":"A2B3C3D3E12","energy_above_hull":3.1105642260869564,"spacegroup":5},{"id":"jvasp-69906","created_at":"2022-09-04T14:35:58.540417Z","updated_at":"2022-09-04T14:35:58.540434Z","structure_string":"Ti1 Be1 Cr1\n1.0\n1.274560 -2.207601 0.000000\n1.274560 2.207601 0.000000\n-0.000000 0.000000 6.623394\nTi Be Cr\n1 1 1\ndirect\n0.333333 0.666667 0.674797 Ti\n0.000000 0.000000 0.015112 Be\n0.666667 0.333333 0.310090 Cr\n","nsites":3,"nelements":3,"elements":["Ti","Be","Cr"],"chemical_system":"Be-Cr-Ti","density":4.850504787051922,"density_atomic":0.08048775275211227,"volume":37.27275141150304,"volume_molar":7.482058517085333,"formula_full":"Ti1 Be1 Cr1","formula_reduced":"TiBeCr","formula_anonymous":"ABC","energy_above_hull":3.198200611111111,"spacegroup":156},{"id":"jvasp-38648","created_at":"2022-09-04T14:35:58.541218Z","updated_at":"2022-09-04T14:35:58.541243Z","structure_string":"Ni1 Ru1 O3\n1.0\n3.713863 0.000000 0.000000\n0.000000 3.713863 0.000000\n-0.000000 -0.000000 3.713863\nNi Ru O\n1 1 3\ndirect\n0.500000 0.500000 0.500000 Ni\n0.000000 0.000000 0.000000 Ru\n0.500000 0.500000 0.000000 O\n0.000000 0.500000 0.500000 O\n0.500000 0.000000 0.500000 O\n","nsites":5,"nelements":3,"elements":["Ni","Ru","O"],"chemical_system":"Ni-O-Ru","density":6.73498668378816,"density_atomic":0.09760956269232199,"volume":51.22448930296562,"volume_molar":6.169621698831465,"formula_full":"Ni1 Ru1 O3","formula_reduced":"NiRuO3","formula_anonymous":"ABC3","energy_above_hull":2.70718868,"spacegroup":221},{"id":"jvasp-50345","created_at":"2022-09-04T14:35:58.542361Z","updated_at":"2022-09-04T14:35:58.542385Z","structure_string":"Ba3 Mg3 O6\n1.0\n5.945290 -0.000009 0.000060\n-2.972653 5.148794 -0.000007\n-0.000077 0.000112 6.799903\nBa Mg O\n3 3 6\ndirect\n0.000001 0.654800 0.166667 Ba\n0.345208 0.345210 0.500002 Ba\n0.654799 0.000001 0.833346 Ba\n0.000006 0.575469 0.666670 Mg\n0.424531 0.424530 0.000004 Mg\n0.575468 0.000006 0.333342 Mg\n0.297080 0.868147 0.539500 O\n0.131844 0.428912 0.872828 O\n0.571072 0.702927 0.206157 O\n0.428914 0.131848 0.127186 O\n0.702923 0.571067 0.793849 O\n0.868153 0.297079 0.460510 O\n","nsites":12,"nelements":3,"elements":["Ba","Mg","O"],"chemical_system":"Ba-Mg-O","density":4.634083917710109,"density_atomic":0.057650137593289165,"volume":208.15214847634422,"volume_molar":10.446012813508037,"formula_full":"Ba3 Mg3 O6","formula_reduced":"BaMgO2","formula_anonymous":"ABC2","energy_above_hull":0.224973005,"spacegroup":152},{"id":"jvasp-67845","created_at":"2022-09-04T14:35:58.545265Z","updated_at":"2022-09-04T14:35:58.545293Z","structure_string":"Sr1 Be1 Re1\n1.0\n-1.622175 1.622175 5.439588\n1.622175 -1.622175 5.439588\n1.622175 1.622175 -5.439588\nSr Be Re\n1 1 1\ndirect\n0.673049 0.673049 0.000000 Sr\n0.934632 0.934632 0.000000 Be\n0.392320 0.392320 0.000000 Re\n","nsites":3,"nelements":3,"elements":["Sr","Be","Re"],"chemical_system":"Be-Re-Sr","density":8.202897099165032,"density_atomic":0.0523962068890852,"volume":57.25605302594792,"volume_molar":11.493467022809412,"formula_full":"Sr1 Be1 Re1","formula_reduced":"SrBeRe","formula_anonymous":"ABC","energy_above_hull":2.5795101366666664,"spacegroup":107},{"id":"jvasp-15435","created_at":"2022-09-04T14:35:58.546174Z","updated_at":"2022-09-04T14:35:58.546201Z","structure_string":"Er1 Mn2 Si2\n1.0\n3.659225 0.000000 -1.283147\n-0.449949 3.631456 -1.283147\n-0.009648 -0.010917 5.831671\nEr Mn Si\n1 2 2\ndirect\n0.000000 0.000000 0.000000 Er\n0.249999 0.750000 0.499999 Mn\n0.749999 0.250000 0.499999 Mn\n0.619635 0.619636 0.239272 Si\n0.380363 0.380364 0.760727 Si\n","nsites":5,"nelements":3,"elements":["Er","Mn","Si"],"chemical_system":"Er-Mn-Si","density":7.151618769686506,"density_atomic":0.06460736272144557,"volume":77.39056029198225,"volume_molar":9.321136951471678,"formula_full":"Er1 Mn2 Si2","formula_reduced":"Er(MnSi)2","formula_anonymous":"AB2C2","energy_above_hull":3.317046336551724,"spacegroup":139},{"id":"jvasp-65751","created_at":"2022-09-04T14:35:58.549728Z","updated_at":"2022-09-04T14:35:58.549760Z","structure_string":"Ba2 Ge1 Pb1\n1.0\n-0.000000 4.172711 4.172711\n4.172711 -0.000000 4.172711\n4.172711 4.172711 -0.000000\nBa Ge Pb\n2 1 1\ndirect\n0.250000 0.250000 0.250000 Ba\n0.750000 0.750000 0.750000 Ba\n0.000000 0.000000 0.000000 Ge\n0.500000 0.500000 0.500000 Pb\n","nsites":4,"nelements":3,"elements":["Ba","Ge","Pb"],"chemical_system":"Ba-Ge-Pb","density":6.336669156427891,"density_atomic":0.02752802636114844,"volume":145.3064577722645,"volume_molar":21.87639855103932,"formula_full":"Ba2 Ge1 Pb1","formula_reduced":"Ba2GePb","formula_anonymous":"ABC2","energy_above_hull":0.0230221774999999,"spacegroup":225},{"id":"jvasp-67569","created_at":"2022-09-04T14:35:58.556145Z","updated_at":"2022-09-04T14:35:58.556162Z","structure_string":"Be1 Co2 Br1\n1.0\n3.064916 -0.000000 0.000000\n-0.000000 3.064916 -0.000000\n0.000000 -0.000000 6.191466\nBe Co Br\n1 2 1\ndirect\n-0.000000 0.000000 0.439858 Be\n-0.000000 0.000000 0.098965 Co\n0.500001 0.500001 0.275219 Co\n0.500001 0.500001 0.685959 Br\n","nsites":4,"nelements":3,"elements":["Be","Co","Br"],"chemical_system":"Be-Br-Co","density":5.903810176495293,"density_atomic":0.06877480161231704,"volume":58.16083661786428,"volume_molar":8.756318620803526,"formula_full":"Be1 Co2 Br1","formula_reduced":"BeCo2Br","formula_anonymous":"ABC2","energy_above_hull":2.17838550125,"spacegroup":99},{"id":"jvasp-86182","created_at":"2022-09-04T14:35:58.556789Z","updated_at":"2022-09-04T14:35:58.556820Z","structure_string":"Ag8 Se4\n1.0\n4.550334 0.000000 0.000000\n0.000000 7.085733 0.000000\n0.000000 0.000000 7.544090\nAg Se\n8 4\ndirect\n0.007621 0.231292 0.876531 Ag\n0.698055 0.878414 0.947963 Ag\n0.492379 0.768707 0.376531 Ag\n0.198055 0.621585 0.052037 Ag\n0.801944 0.121586 0.447963 Ag\n0.992378 0.731292 0.623469 Ag\n0.301944 0.378414 0.552037 Ag\n0.507621 0.268708 0.123469 Ag\n0.879018 0.492897 0.329120 Se\n0.120981 0.992896 0.170880 Se\n0.379018 0.007103 0.670880 Se\n0.620981 0.507103 0.829120 Se\n","nsites":12,"nelements":2,"elements":["Ag","Se"],"chemical_system":"Ag-Se","density":8.047277903487482,"density_atomic":0.049333999621020155,"volume":243.2399580853578,"volume_molar":12.206877217054377,"formula_full":"Ag8 Se4","formula_reduced":"Ag2Se","formula_anonymous":"AB2","energy_above_hull":0.2296126288888889,"spacegroup":19}]}