{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=4373","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=4371","results":[{"id":"jvasp-48267","created_at":"2022-09-04T14:35:51.782785Z","updated_at":"2022-09-04T14:35:51.782800Z","structure_string":"Li5 Co2 O6\n1.0\n-5.399323 0.039683 0.001654\n0.052828 5.320164 0.050378\n0.012734 -2.617328 -4.829100\nLi Co O\n5 2 6\ndirect\n0.833746 0.658267 0.204438 Li\n0.863434 -0.001823 0.836448 Li\n0.408248 0.269837 0.890406 Li\n0.183892 -0.001945 0.204676 Li\n0.086663 0.519144 0.811384 Li\n0.675364 0.300390 0.499119 Co\n0.346459 0.656478 0.495224 Co\n0.814204 0.021303 0.200540 O\n0.767647 0.342773 0.832611 O\n0.701103 0.668301 0.519951 O\n0.319933 0.305592 0.524192 O\n0.223873 0.608476 0.171074 O\n0.219766 0.918173 0.818348 O\n","nsites":13,"nelements":3,"elements":["Li","Co","O"],"chemical_system":"Co-Li-O","density":2.990661109838704,"density_atomic":0.09419256142426805,"volume":138.01514475696848,"volume_molar":6.39343560567877,"formula_full":"Li5 Co2 O6","formula_reduced":"Li5(CoO3)2","formula_anonymous":"A2B5C6","energy_above_hull":2.1911732923076928,"spacegroup":1},{"id":"jvasp-42229","created_at":"2022-09-04T14:35:51.531342Z","updated_at":"2022-09-04T14:35:51.531368Z","structure_string":"Y6 N2 O5\n1.0\n-4.764208 -0.000561 0.001763\n2.381429 5.404913 0.007178\n-0.002606 -1.117651 -7.501284\nY N O\n6 2 5\ndirect\n0.290632 0.581976 0.859313 Y\n0.564972 0.130664 0.714908 Y\n0.144738 0.290185 0.420151 Y\n0.854520 0.709757 0.576015 Y\n0.708634 0.417965 0.136853 Y\n0.434276 0.869276 0.281257 Y\n0.357039 0.714795 0.572480 N\n0.642216 0.285145 0.423686 N\n0.078727 0.158194 0.699959 O\n0.499609 -0.000029 0.998083 O\n0.771779 0.544253 0.852335 O\n0.920522 0.841748 0.296209 O\n0.227497 0.455688 0.143828 O\n","nsites":13,"nelements":3,"elements":["Y","N","O"],"chemical_system":"N-O-Y","density":5.515854582879939,"density_atomic":0.06732049494096573,"volume":193.10612632007354,"volume_molar":8.945479033214028,"formula_full":"Y6 N2 O5","formula_reduced":"Y6N2O5","formula_anonymous":"A2B5C6","energy_above_hull":3.5327059,"spacegroup":12},{"id":"jvasp-44791","created_at":"2022-09-04T14:38:34.251596Z","updated_at":"2022-09-04T14:38:34.251619Z","structure_string":"Sc6 N2 O5\n1.0\n5.441307 0.000001 -0.004168\n-0.916799 5.368191 -0.000763\n-0.935271 -1.101370 5.254194\nSc N O\n6 2 5\ndirect\n0.153214 0.573077 0.275377 Sc\n0.718823 0.852926 0.432134 Sc\n0.434069 0.726442 0.859654 Sc\n0.562900 0.270465 0.148144 Sc\n0.277608 0.141941 0.556530 Sc\n0.853089 0.436071 0.724346 Sc\n0.373835 0.921963 0.223522 N\n0.501541 0.499377 0.500978 N\n0.076986 0.772707 0.624784 O\n0.776161 0.623066 0.076826 O\n0.223197 0.375874 0.919954 O\n0.921159 0.225755 0.379511 O\n0.627418 0.080332 0.778238 O\n","nsites":13,"nelements":3,"elements":["Sc","N","O"],"chemical_system":"N-O-Sc","density":4.087856013245885,"density_atomic":0.08472081363989709,"volume":153.4451741133655,"volume_molar":7.108218749641502,"formula_full":"Sc6 N2 O5","formula_reduced":"Sc6N2O5","formula_anonymous":"A2B5C6","energy_above_hull":3.351598115384615,"spacegroup":1},{"id":"jvasp-55250","created_at":"2022-09-04T14:38:36.910629Z","updated_at":"2022-09-04T14:38:36.910655Z","structure_string":"Sr10 Sn4 P12\n1.0\n4.164019 0.000000 0.000000\n0.000000 12.236342 0.000000\n0.000000 -0.000000 13.871363\nSr Sn P\n10 4 12\ndirect\n0.000000 0.628185 0.069639 Sr\n0.000000 0.619598 0.741564 Sr\n0.000000 0.128186 0.430361 Sr\n0.000000 0.871814 0.569639 Sr\n0.000000 0.500000 0.500000 Sr\n0.000000 0.000000 0.000000 Sr\n0.000000 0.880401 0.241564 Sr\n0.000000 0.119598 0.758436 Sr\n0.000000 0.380402 0.258436 Sr\n0.000000 0.371814 0.930361 Sr\n0.500000 0.714436 0.395732 Sn\n0.500000 0.785564 0.895732 Sn\n0.500000 0.285564 0.604268 Sn\n0.500000 0.214436 0.104268 Sn\n0.000000 0.367155 0.695202 P\n0.000000 0.632844 0.304797 P\n0.500000 0.078133 0.602750 P\n0.500000 0.421867 0.102751 P\n0.500000 0.578133 0.897249 P\n0.500000 0.670141 0.576667 P\n0.500000 0.329859 0.423333 P\n0.500000 0.170141 0.923333 P\n0.500000 0.829859 0.076667 P\n0.500000 0.921867 0.397249 P\n0.000000 0.867155 0.804797 P\n0.000000 0.132844 0.195203 P\n","nsites":26,"nelements":3,"elements":["Sr","Sn","P"],"chemical_system":"P-Sn-Sr","density":4.047451410136317,"density_atomic":0.03678662131999628,"volume":706.7786892912358,"volume_molar":16.370464434923562,"formula_full":"Sr10 Sn4 P12","formula_reduced":"Sr5(SnP3)2","formula_anonymous":"A2B5C6","energy_above_hull":1.425325226923077,"spacegroup":55},{"id":"jvasp-111858","created_at":"2022-09-04T14:38:42.388065Z","updated_at":"2022-09-04T14:38:42.388092Z","structure_string":"Sr10 V4 N12\n1.0\n6.046044 0.008323 -1.039587\n-3.562041 5.503886 -0.000000\n-0.027232 -0.017624 13.677407\nSr V N\n10 4 12\ndirect\n0.137889 0.809617 0.997993 Sr\n0.862112 0.671728 0.502007 Sr\n0.862111 0.190384 0.002007 Sr\n0.137889 0.328273 0.497993 Sr\n0.315672 0.068737 0.718027 Sr\n0.684329 0.753064 0.781973 Sr\n0.684328 0.931264 0.281973 Sr\n0.315672 0.246937 0.218027 Sr\n0.000001 0.381839 0.750000 Sr\n0.000001 0.618162 0.250000 Sr\n0.551085 0.639772 0.073789 V\n0.448915 0.088687 0.426210 V\n0.551086 0.911314 0.573790 V\n0.448915 0.360229 0.926211 V\n0.452840 0.790287 0.433949 N\n0.881293 0.991605 0.628374 N\n0.118708 0.110312 0.871627 N\n0.118707 0.008396 0.371626 N\n0.881293 0.889689 0.128373 N\n0.298992 0.697113 0.641763 N\n0.701009 0.398122 0.858237 N\n0.701008 0.302888 0.358237 N\n0.298992 0.601879 0.141763 N\n0.547161 0.209714 0.566051 N\n0.452840 0.662555 0.933949 N\n0.547161 0.337446 0.066051 N\n","nsites":26,"nelements":3,"elements":["Sr","V","N"],"chemical_system":"N-Sr-V","density":4.551550783624268,"density_atomic":0.057102209270696626,"volume":455.32388907660925,"volume_molar":10.54624827465372,"formula_full":"Sr10 V4 N12","formula_reduced":"Sr5(VN3)2","formula_anonymous":"A2B5C6","energy_above_hull":3.3894622653846147,"spacegroup":15},{"id":"jvasp-27531","created_at":"2022-09-04T14:38:33.588920Z","updated_at":"2022-09-04T14:38:33.588945Z","structure_string":"Ca10 Al4 Sb12\n1.0\n4.478103 0.000000 0.000000\n0.000000 12.044961 -0.000000\n0.000000 0.000000 14.090585\nCa Al Sb\n10 4 12\ndirect\n0.500000 0.091801 0.746965 Ca\n0.500000 0.408199 0.246965 Ca\n0.500000 0.326343 0.513101 Ca\n0.500000 0.908199 0.253035 Ca\n0.500000 0.500000 0.000000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.173657 0.013101 Ca\n0.500000 0.826343 0.986899 Ca\n0.500000 0.673657 0.486899 Ca\n0.500000 0.591801 0.753035 Ca\n0.000000 0.331711 0.712430 Al\n0.000000 0.668289 0.287570 Al\n0.000000 0.168289 0.212430 Al\n0.000000 0.831711 0.787570 Al\n0.000000 0.026644 0.899224 Sb\n0.000000 0.844259 0.406685 Sb\n0.000000 0.155741 0.593315 Sb\n0.000000 0.655741 0.906685 Sb\n0.000000 0.344259 0.093315 Sb\n0.500000 0.338099 0.823223 Sb\n0.500000 0.661901 0.176776 Sb\n0.500000 0.838099 0.676776 Sb\n0.500000 0.161901 0.323223 Sb\n0.000000 0.526644 0.600776 Sb\n0.000000 0.473356 0.399224 Sb\n0.000000 0.973356 0.100776 Sb\n","nsites":26,"nelements":3,"elements":["Ca","Al","Sb"],"chemical_system":"Al-Ca-Sb","density":4.303764473217181,"density_atomic":0.03420935195592214,"volume":760.0260897517242,"volume_molar":17.603784975989523,"formula_full":"Ca10 Al4 Sb12","formula_reduced":"Ca5(AlSb3)2","formula_anonymous":"A2B5C6","energy_above_hull":0.9600603307692306,"spacegroup":55},{"id":"jvasp-119512","created_at":"2022-09-04T14:38:51.691731Z","updated_at":"2022-09-04T14:38:51.691751Z","structure_string":"Ca10 Rh4 N12\n1.0\n5.903544 -0.051268 -1.228674\n-3.647906 5.507141 0.000000\n-0.222819 -0.147594 12.008015\nCa Rh N\n10 4 12\ndirect\n-0.000000 0.394266 0.750000 Ca\n-0.000000 0.605735 0.250000 Ca\n0.118069 0.805898 0.000354 Ca\n0.881929 0.687828 0.499646 Ca\n0.881930 0.194102 -0.000354 Ca\n0.118069 0.312172 0.500355 Ca\n0.331327 0.049492 0.734588 Ca\n0.668672 0.718165 0.765413 Ca\n0.668672 0.950509 0.265413 Ca\n0.331326 0.281835 0.234587 Ca\n0.524895 0.692247 0.035984 Rh\n0.475103 0.167352 0.464017 Rh\n0.524895 0.832648 0.535984 Rh\n0.475103 0.307753 0.964017 Rh\n0.103544 -0.002293 0.374612 N\n0.265310 0.682471 0.628592 N\n0.734688 0.417160 0.871409 N\n0.734688 0.317530 0.371409 N\n0.265310 0.582840 0.128591 N\n0.574434 0.348442 0.607603 N\n0.425564 0.774007 0.892398 N\n0.425564 0.651558 0.392397 N\n0.574434 0.225994 0.107603 N\n0.896455 0.002293 0.625388 N\n0.103544 0.105838 0.874613 N\n0.896454 0.894162 0.125388 N\n","nsites":26,"nelements":3,"elements":["Ca","Rh","N"],"chemical_system":"Ca-N-Rh","density":4.2181112569725645,"density_atomic":0.06736006207044623,"volume":385.98539254326676,"volume_molar":8.940224481536179,"formula_full":"Ca10 Rh4 N12","formula_reduced":"Ca5(RhN3)2","formula_anonymous":"A2B5C6","energy_above_hull":3.2127067384615384,"spacegroup":15},{"id":"jvasp-120560","created_at":"2022-09-04T14:38:51.211918Z","updated_at":"2022-09-04T14:38:51.211938Z","structure_string":"Ba10 Sn4 N12\n1.0\n6.634779 0.042261 -0.849663\n-4.016894 6.054356 0.000000\n-0.089552 -0.059415 14.638233\nBa Sn N\n10 4 12\ndirect\n0.096004 0.772775 0.991991 Ba\n0.903997 0.676772 0.508009 Ba\n0.903997 0.227225 0.008009 Ba\n0.096003 0.323228 0.491991 Ba\n0.315426 0.069282 0.713211 Ba\n0.684575 0.753857 0.786789 Ba\n0.684575 0.930718 0.286789 Ba\n0.315426 0.246143 0.213211 Ba\n0.000000 0.375269 0.750000 Ba\n0.000001 0.624731 0.250000 Ba\n0.558092 0.664795 0.074944 Sn\n0.441909 0.106703 0.425056 Sn\n0.558092 0.893297 0.574944 Sn\n0.441909 0.335204 0.925056 Sn\n0.392219 0.779308 0.432765 N\n0.902922 0.973946 0.624326 N\n0.097079 0.071025 0.875674 N\n0.097079 0.026053 0.375674 N\n0.902922 0.928975 0.124326 N\n0.288462 0.693719 0.653635 N\n0.711539 0.405257 0.846365 N\n0.711539 0.306281 0.346365 N\n0.288462 0.594742 0.153635 N\n0.607782 0.220692 0.567235 N\n0.392218 0.612909 0.932765 N\n0.607782 0.387090 0.067235 N\n","nsites":26,"nelements":3,"elements":["Ba","Sn","N"],"chemical_system":"Ba-N-Sn","density":5.676155849636791,"density_atomic":0.04408055148782557,"volume":589.8292812235082,"volume_molar":13.66167290729843,"formula_full":"Ba10 Sn4 N12","formula_reduced":"Ba5(SnN3)2","formula_anonymous":"A2B5C6","energy_above_hull":2.8459925192307693,"spacegroup":15},{"id":"jvasp-31641","created_at":"2022-09-04T14:37:07.542170Z","updated_at":"2022-09-04T14:37:07.542189Z","structure_string":"Sn5 B2 Rh6\n1.0\n3.338120 -5.781793 -0.000000\n3.338120 5.781793 0.000000\n0.000000 0.000000 5.623132\nSn B Rh\n5 2 6\ndirect\n0.595860 0.595860 0.000000 Sn\n0.000000 0.404140 0.000000 Sn\n0.404140 0.000000 0.000000 Sn\n0.666667 0.333333 0.500000 Sn\n0.333333 0.666667 0.500000 Sn\n0.000000 0.000000 0.500000 B\n0.000000 0.000000 0.000000 B\n0.000000 0.748681 0.252921 Rh\n0.251319 0.251319 0.747079 Rh\n0.748681 0.000000 0.747079 Rh\n0.000000 0.748681 0.747079 Rh\n0.251319 0.251319 0.252921 Rh\n0.748681 0.000000 0.252921 Rh\n","nsites":13,"nelements":3,"elements":["Sn","B","Rh"],"chemical_system":"B-Rh-Sn","density":9.42975186077699,"density_atomic":0.059892245264479754,"volume":217.05648106182954,"volume_molar":10.054959090958551,"formula_full":"Sn5 B2 Rh6","formula_reduced":"Sn5(BRh3)2","formula_anonymous":"A2B5C6","energy_above_hull":2.653275512820513,"spacegroup":189},{"id":"jvasp-58374","created_at":"2022-09-04T14:37:19.605089Z","updated_at":"2022-09-04T14:37:19.605107Z","structure_string":"Pr5 Co2 B6\n1.0\n5.220463 0.007138 7.195583\n2.340463 4.666425 7.195583\n0.011548 0.007138 8.889855\nPr Co B\n5 2 6\ndirect\n0.583856 0.583856 0.583856 Pr\n0.416143 0.416143 0.416143 Pr\n0.748549 0.748550 0.748550 Pr\n0.251450 0.251450 0.251450 Pr\n0.000000 0.000000 0.000000 Pr\n0.877194 0.877194 0.877194 Co\n0.122805 0.122805 0.122805 Co\n0.832733 0.500000 0.167266 B\n0.500000 0.167266 0.832733 B\n0.167266 0.832733 0.500000 B\n0.167266 0.500000 0.832734 B\n0.500000 0.832733 0.167266 B\n0.832733 0.167266 0.500000 B\n","nsites":13,"nelements":3,"elements":["Pr","Co","B"],"chemical_system":"B-Co-Pr","density":6.824805266407959,"density_atomic":0.0602182885083763,"volume":215.88126002936323,"volume_molar":10.000517964176822,"formula_full":"Pr5 Co2 B6","formula_reduced":"Pr5(CoB3)2","formula_anonymous":"A2B5C6","energy_above_hull":3.929859734615385,"spacegroup":166},{"id":"jvasp-85219","created_at":"2022-09-04T14:37:08.247868Z","updated_at":"2022-09-04T14:37:08.247900Z","structure_string":"La5 B2 N6\n1.0\n3.699512 -0.000000 0.000000\n-1.849757 6.049615 -1.711583\n0.000000 0.030416 9.053317\nLa B N\n5 2 6\ndirect\n0.374822 0.749645 0.626730 La\n0.691712 0.383427 0.818360 La\n0.000000 0.000000 0.000000 La\n0.308287 0.616574 0.181641 La\n0.625178 0.250356 0.373271 La\n0.945516 0.891036 0.411197 B\n0.054483 0.108965 0.588804 B\n0.974227 0.948456 0.263616 N\n0.656308 0.312616 0.079484 N\n0.170661 0.341323 0.582723 N\n0.025772 0.051545 0.736385 N\n0.343691 0.687385 0.920517 N\n0.829339 0.658678 0.417278 N\n","nsites":13,"nelements":3,"elements":["La","B","N"],"chemical_system":"B-La-N","density":6.551631399192926,"density_atomic":0.06409893813206308,"volume":202.8114720592733,"volume_molar":9.395071019105778,"formula_full":"La5 B2 N6","formula_reduced":"La5(BN3)2","formula_anonymous":"A2B5C6","energy_above_hull":4.542900743589743,"spacegroup":12},{"id":"jvasp-116836","created_at":"2022-09-04T14:38:45.621155Z","updated_at":"2022-09-04T14:38:45.621184Z","structure_string":"Li2 Fe5 O5 F7\n1.0\n5.682960 -0.011106 -1.053254\n-1.154814 5.623807 -1.018802\n-0.035843 -0.037564 6.193701\nLi Fe O F\n2 5 5 7\ndirect\n0.867251 0.676251 0.403532 Li\n0.323330 0.607275 0.137529 Li\n0.657734 0.384910 0.840990 Fe\n0.137698 0.328429 0.579344 Fe\n0.621300 0.149230 0.347359 Fe\n0.985489 0.010259 0.013799 Fe\n0.400603 0.860963 0.675260 Fe\n0.838871 0.403959 0.608064 O\n0.402941 0.579815 0.776186 O\n0.957891 0.125566 0.315514 O\n0.391064 0.157449 0.575095 O\n0.667227 0.043560 0.882248 O\n0.118831 0.316474 0.959092 F\n0.182108 0.616211 0.398826 F\n0.580287 0.403310 0.177272 F\n0.059848 0.885273 0.712143 F\n0.613905 0.825983 0.430203 F\n0.873222 0.678053 0.042417 F\n0.320411 0.947034 0.125141 F\n","nsites":19,"nelements":4,"elements":["Li","Fe","O","F"],"chemical_system":"F-Fe-Li-O","density":4.257396655329475,"density_atomic":0.09625392324665814,"volume":197.39455140245065,"volume_molar":6.256514598961123,"formula_full":"Li2 Fe5 O5 F7","formula_reduced":"Li2Fe5O5F7","formula_anonymous":"A2B5C5D7","energy_above_hull":1.8582829988157896,"spacegroup":1}]}