{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3415","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3413","results":[{"id":"jvasp-119404","created_at":"2022-09-04T14:38:51.138185Z","updated_at":"2022-09-04T14:38:51.138210Z","structure_string":"La3 Ir9\n1.0\n5.212636 0.014130 7.887644\n2.381343 4.636915 7.887644\n0.023070 0.014130 9.454416\nLa Ir\n3 9\ndirect\n0.860482 0.860481 0.860482 La\n0.139519 0.139518 0.139519 La\n0.000000 0.000000 0.000000 La\n0.421138 0.916262 0.421138 Ir\n0.421138 0.421137 0.916264 Ir\n0.916264 0.421137 0.421137 Ir\n0.578863 0.083737 0.578862 Ir\n0.578863 0.578862 0.083736 Ir\n0.083737 0.578862 0.578863 Ir\n0.668148 0.668147 0.668148 Ir\n0.331852 0.331852 0.331852 Ir\n0.500000 0.500000 0.500000 Ir\n","nsites":12,"nelements":2,"elements":["La","Ir"],"chemical_system":"Ir-La","density":15.70019636809733,"density_atomic":0.05285329473493373,"volume":227.04355632286672,"volume_molar":11.394068790227427,"formula_full":"La3 Ir9","formula_reduced":"LaIr3","formula_anonymous":"AB3","energy_above_hull":3.776767075,"spacegroup":166},{"id":"jvasp-119557","created_at":"2022-09-04T14:38:51.620415Z","updated_at":"2022-09-04T14:38:51.620437Z","structure_string":"Er4 Ga4 Ir4\n1.0\n4.276447 0.000000 0.000000\n0.000000 6.770063 0.000000\n-0.000000 0.000000 7.787739\nEr Ga Ir\n4 4 4\ndirect\n0.250000 0.974526 0.313565 Er\n0.250000 0.474526 0.186435 Er\n0.750001 0.025473 0.686435 Er\n0.750001 0.525473 0.813565 Er\n0.250000 0.344919 0.567994 Ga\n0.250000 0.844919 0.932007 Ga\n0.750001 0.655081 0.432007 Ga\n0.750001 0.155081 0.067994 Ga\n0.250000 0.233419 0.887232 Ir\n0.250000 0.733419 0.612768 Ir\n0.750001 0.766580 0.112768 Ir\n0.750001 0.266580 0.387232 Ir\n","nsites":12,"nelements":3,"elements":["Er","Ga","Ir"],"chemical_system":"Er-Ga-Ir","density":12.643886773860702,"density_atomic":0.05322235088991698,"volume":225.46918351690869,"volume_molar":11.3150596681758,"formula_full":"Er4 Ga4 Ir4","formula_reduced":"ErGaIr","formula_anonymous":"ABC","energy_above_hull":1.3224844749999998,"spacegroup":62},{"id":"jvasp-122089","created_at":"2022-09-04T14:38:55.338588Z","updated_at":"2022-09-04T14:38:55.338619Z","structure_string":"Zr4 Si4 As4\n1.0\n3.619827 -0.000000 0.000000\n0.000000 6.552681 0.000000\n0.000000 0.000000 9.352077\nZr Si As\n4 4 4\ndirect\n0.250000 0.723474 0.839454 Zr\n0.750001 0.276526 0.160546 Zr\n0.750001 0.776525 0.339454 Zr\n0.250000 0.223474 0.660546 Zr\n0.250000 0.614706 0.540707 Si\n0.750001 0.385294 0.459293 Si\n0.750001 0.885294 0.040707 Si\n0.250000 0.114706 0.959293 Si\n0.250000 0.614340 0.144091 As\n0.750001 0.385660 0.855909 As\n0.750001 0.885660 0.644091 As\n0.250000 0.114340 0.355909 As\n","nsites":12,"nelements":3,"elements":["Zr","Si","As"],"chemical_system":"As-Si-Zr","density":5.815846607846367,"density_atomic":0.05409614668782111,"volume":221.82726006807448,"volume_molar":11.132291537792264,"formula_full":"Zr4 Si4 As4","formula_reduced":"ZrSiAs","formula_anonymous":"ABC","energy_above_hull":null,"spacegroup":62},{"id":"jvasp-119475","created_at":"2022-09-04T14:38:51.021936Z","updated_at":"2022-09-04T14:38:51.021966Z","structure_string":"Zr3 Mn8 Si1\n1.0\n4.825721 0.000000 0.000000\n-2.412861 4.179197 0.000000\n-0.000000 -0.000000 8.008928\nZr Mn Si\n3 8 1\ndirect\n0.333334 0.666667 0.556156 Zr\n0.333334 0.666667 0.935332 Zr\n0.000000 0.000000 0.079452 Zr\n0.666667 0.333334 0.498280 Mn\n0.666667 0.333334 0.988866 Mn\n0.495854 0.504147 0.256096 Mn\n0.495854 0.991709 0.256096 Mn\n0.008292 0.504147 0.256096 Mn\n0.840964 0.159036 0.744794 Mn\n0.840964 0.681930 0.744794 Mn\n0.318071 0.159036 0.744794 Mn\n0.000000 0.000000 0.439306 Si\n","nsites":12,"nelements":3,"elements":["Zr","Mn","Si"],"chemical_system":"Mn-Si-Zr","density":7.62063761600466,"density_atomic":0.07429366850800667,"volume":161.52116648684205,"volume_molar":8.105860002526311,"formula_full":"Zr3 Mn8 Si1","formula_reduced":"Zr3Mn8Si","formula_anonymous":"AB3C8","energy_above_hull":5.065557502586207,"spacegroup":156},{"id":"jvasp-119564","created_at":"2022-09-04T14:38:51.391727Z","updated_at":"2022-09-04T14:38:51.391750Z","structure_string":"Er2 Co6 Si4\n1.0\n5.742328 -0.001269 -2.421828\n-1.415462 4.514066 -4.057000\n-0.037125 0.001269 6.232030\nEr Co Si\n2 6 4\ndirect\n0.250000 0.535077 0.285077 Er\n0.750000 0.464924 0.714923 Er\n-0.000000 0.000000 0.500000 Co\n0.500000 -0.000000 -0.000000 Co\n0.722113 0.000000 0.722113 Co\n0.222113 0.500000 0.722113 Co\n0.277887 0.000000 0.277887 Co\n0.777887 0.500000 0.277887 Co\n0.080761 0.876418 0.795656 Si\n0.919239 0.123583 0.204344 Si\n0.580762 0.785107 0.204345 Si\n0.419238 0.214894 0.795656 Si\n","nsites":12,"nelements":3,"elements":["Er","Co","Si"],"chemical_system":"Co-Er-Si","density":8.247733794627274,"density_atomic":0.0744607831218958,"volume":161.15865959071954,"volume_molar":8.087667772901975,"formula_full":"Er2 Co6 Si4","formula_reduced":"ErCo3Si2","formula_anonymous":"AB2C3","energy_above_hull":3.1168849833333336,"spacegroup":74},{"id":"jvasp-120528","created_at":"2022-09-04T14:38:51.099731Z","updated_at":"2022-09-04T14:38:51.099765Z","structure_string":"K1 U2 Sb1 Se8\n1.0\n6.874206 0.012557 1.064741\n-2.505567 6.401328 1.064741\n0.026465 0.038855 7.415028\nK U Sb Se\n1 2 1 8\ndirect\n0.117791 0.117791 0.529416 K\n0.495224 -0.004069 0.016550 U\n-0.004070 0.495224 0.016550 U\n0.582066 0.582066 0.665592 Sb\n0.063904 0.809134 0.234820 Se\n0.809134 0.063905 0.234820 Se\n0.781334 0.781334 0.893804 Se\n0.269343 0.269343 0.898009 Se\n0.574799 0.314664 0.239494 Se\n0.314664 0.574799 0.239494 Se\n0.812435 0.320349 0.732464 Se\n0.320349 0.812435 0.732464 Se\n","nsites":12,"nelements":4,"elements":["K","U","Sb","Se"],"chemical_system":"K-Sb-Se-U","density":6.462683310996012,"density_atomic":0.03681473211465015,"volume":325.95646662942,"volume_molar":16.357964363955084,"formula_full":"K1 U2 Sb1 Se8","formula_reduced":"KU2SbSe8","formula_anonymous":"ABC2D8","energy_above_hull":2.337476919444444,"spacegroup":8},{"id":"jvasp-119000","created_at":"2022-09-04T14:38:50.992322Z","updated_at":"2022-09-04T14:38:50.992347Z","structure_string":"Mn4 O6 F2\n1.0\n5.038263 0.029502 -1.780128\n-2.251881 4.340615 -2.154510\n-0.006452 -0.029502 5.343492\nMn O F\n4 6 2\ndirect\n0.469336 0.719336 0.750000 Mn\n0.530664 0.280665 0.250000 Mn\n0.000000 0.000000 0.500000 Mn\n0.000000 0.500001 0.000000 Mn\n0.189100 0.439100 0.750000 O\n0.693161 -0.000000 0.193161 O\n0.693161 0.500001 0.693161 O\n0.306839 0.500001 0.306839 O\n0.306839 0.000000 0.806839 O\n0.810901 0.560901 0.250000 O\n0.217867 0.967867 0.250000 F\n0.782134 0.032134 0.749999 F\n","nsites":12,"nelements":3,"elements":["Mn","O","F"],"chemical_system":"F-Mn-O","density":5.032421615104923,"density_atomic":0.1028059813824381,"volume":116.72472592192878,"volume_molar":5.857772747285632,"formula_full":"Mn4 O6 F2","formula_reduced":"Mn2O3F","formula_anonymous":"AB2C3","energy_above_hull":2.56702254420977,"spacegroup":74},{"id":"jvasp-119132","created_at":"2022-09-04T14:38:48.746787Z","updated_at":"2022-09-04T14:38:48.746812Z","structure_string":"Tl2 Bi2 F8\n1.0\n3.818199 -0.000000 0.000000\n0.000000 6.509580 0.000000\n-0.000000 -0.000000 8.124104\nTl Bi F\n2 2 8\ndirect\n-0.000000 0.251761 0.373360 Tl\n-0.000000 0.751761 0.626640 Tl\n0.500000 0.762789 0.133183 Bi\n0.500000 0.262789 0.866817 Bi\n-0.000000 0.497540 0.913074 F\n-0.000000 0.997540 0.086925 F\n0.500000 0.440110 0.637429 F\n0.500000 0.940110 0.362570 F\n-0.000000 0.655248 0.270484 F\n-0.000000 0.155248 0.729516 F\n0.500000 0.392552 0.144890 F\n0.500000 0.892552 0.855110 F\n","nsites":12,"nelements":3,"elements":["Tl","Bi","F"],"chemical_system":"Bi-F-Tl","density":8.048559763812564,"density_atomic":0.05942842813857506,"volume":201.9235637869881,"volume_molar":10.133434365717344,"formula_full":"Tl2 Bi2 F8","formula_reduced":"TlBiF4","formula_anonymous":"ABC4","energy_above_hull":0.0039449999999996,"spacegroup":26},{"id":"jvasp-119547","created_at":"2022-09-04T14:38:48.748806Z","updated_at":"2022-09-04T14:38:48.748821Z","structure_string":"Na2 Mn2 O8\n1.0\n5.217959 0.066317 0.000000\n-2.062925 4.793311 0.000000\n-0.000000 -0.000000 7.079207\nNa Mn O\n2 2 8\ndirect\n0.000000 0.000000 0.000000 Na\n0.000000 0.000000 0.500000 Na\n0.371696 0.628304 0.750000 Mn\n0.628303 0.371697 0.250000 Mn\n0.290636 0.250347 0.250000 O\n0.250347 0.290636 0.750000 O\n0.266366 0.733633 0.563087 O\n0.733633 0.266367 0.063087 O\n0.733633 0.266367 0.436914 O\n0.266366 0.733633 0.936914 O\n0.749653 0.709364 0.250000 O\n0.709364 0.749654 0.750000 O\n","nsites":12,"nelements":3,"elements":["Na","Mn","O"],"chemical_system":"Mn-Na-O","density":2.647581562449548,"density_atomic":0.06740487852319209,"volume":178.02865701881123,"volume_molar":8.934280265675362,"formula_full":"Na2 Mn2 O8","formula_reduced":"NaMnO4","formula_anonymous":"ABC4","energy_above_hull":2.169593373563219,"spacegroup":63},{"id":"jvasp-118961","created_at":"2022-09-04T14:38:50.646652Z","updated_at":"2022-09-04T14:38:50.646681Z","structure_string":"Ba8 In4\n1.0\n5.902402 -0.000000 0.000000\n0.000000 8.049115 0.000000\n-0.000000 -0.000000 10.933828\nBa In\n8 4\ndirect\n0.250000 0.021347 0.694848 Ba\n0.250000 0.521347 0.805153 Ba\n0.750000 0.978652 0.305152 Ba\n0.750000 0.478653 0.194848 Ba\n0.250000 0.678009 0.425739 Ba\n0.250000 0.178009 0.074261 Ba\n0.750000 0.321991 0.574261 Ba\n0.750000 0.821991 0.925739 Ba\n0.250000 0.229657 0.396032 In\n0.250000 0.729656 0.103968 In\n0.750000 0.770343 0.603968 In\n0.750000 0.270343 0.896032 In\n","nsites":12,"nelements":2,"elements":["Ba","In"],"chemical_system":"Ba-In","density":4.98007833869676,"density_atomic":0.02310106972657059,"volume":519.4564642258854,"volume_molar":26.068666218834885,"formula_full":"Ba8 In4","formula_reduced":"Ba2In","formula_anonymous":"AB2","energy_above_hull":0.0,"spacegroup":62},{"id":"jvasp-122108","created_at":"2022-09-04T14:38:55.272181Z","updated_at":"2022-09-04T14:38:55.272210Z","structure_string":"Nb4 S4 Br4\n1.0\n6.306691 -0.000000 3.641170\n2.102230 5.946005 3.641170\n-0.000000 -0.000000 7.282339\nNb S Br\n4 4 4\ndirect\n0.351633 0.351633 0.351633 Nb\n0.351633 0.351633 0.945103 Nb\n0.351633 0.945102 0.351633 Nb\n0.945102 0.351633 0.351633 Nb\n0.119038 0.119038 0.119038 S\n0.119038 0.119038 0.642886 S\n0.119039 0.642885 0.119039 S\n0.642886 0.119038 0.119039 S\n0.623407 0.623406 0.623407 Br\n0.623407 0.623406 0.129781 Br\n0.623407 0.129780 0.623407 Br\n0.129781 0.623406 0.623407 Br\n","nsites":12,"nelements":3,"elements":["Nb","S","Br"],"chemical_system":"Br-Nb-S","density":4.983117708070681,"density_atomic":0.04394237551435518,"volume":273.0849176799697,"volume_molar":13.704631780848253,"formula_full":"Nb4 S4 Br4","formula_reduced":"NbSBr","formula_anonymous":"ABC","energy_above_hull":null,"spacegroup":216},{"id":"jvasp-122099","created_at":"2022-09-04T14:38:55.243044Z","updated_at":"2022-09-04T14:38:55.243071Z","structure_string":"Rb1 Tm1 W2 O8\n1.0\n5.980666 -0.000000 0.000000\n-2.990332 5.179410 0.000000\n-0.000000 -0.000000 7.529387\nRb Tm W O\n1 1 2 8\ndirect\n0.000000 0.000000 0.000000 Rb\n0.000000 0.000000 0.500000 Tm\n0.333334 0.666667 0.242186 W\n0.666667 0.333333 0.757814 W\n0.168071 0.831930 0.320151 O\n0.831930 0.168070 0.679850 O\n0.168071 0.336141 0.320151 O\n0.831930 0.663859 0.679850 O\n0.663860 0.831930 0.320151 O\n0.336141 0.168070 0.679850 O\n0.333334 0.666667 0.007907 O\n0.666667 0.333333 0.992094 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