{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=73","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nsites&page=71","results":[{"id":"jvasp-97849","created_at":"2022-09-04T14:36:13.323428Z","updated_at":"2022-09-04T14:36:13.323462Z","structure_string":"Na8 Li12 Co4 O16\n1.0\n6.533595 0.000000 0.000000\n0.000000 7.935490 0.000000\n0.000000 0.000000 8.183640\nNa Li Co O\n8 12 4 16\ndirect\n0.755593 0.000000 0.500000 Na\n0.000000 0.257216 0.749962 Na\n0.000000 0.742784 0.250038 Na\n0.500000 0.757216 0.750038 Na\n0.500000 0.242784 0.249962 Na\n0.744408 0.500000 0.000000 Na\n0.255593 0.500000 0.000000 Na\n0.244408 0.000000 0.500000 Na\n0.245867 0.488367 0.350860 Li\n0.245867 0.511633 0.649140 Li\n0.745867 0.011633 0.850860 Li\n0.745867 0.988367 0.149140 Li\n0.754134 0.511633 0.649140 Li\n0.254133 0.988367 0.149140 Li\n0.254133 0.011633 0.850860 Li\n0.000000 0.735561 0.593085 Li\n0.500000 0.764439 0.093085 Li\n0.500000 0.235561 0.906915 Li\n0.754134 0.488367 0.350860 Li\n0.000000 0.264439 0.406915 Li\n0.000000 0.773140 0.881836 Co\n0.500000 0.726860 0.381835 Co\n0.500000 0.273140 0.618165 Co\n0.000000 0.226860 0.118165 Co\n0.000000 0.046035 0.276392 O\n0.000000 0.953965 0.723608 O\n0.252082 0.304000 0.510888 O\n0.252082 0.696000 0.489112 O\n0.247919 0.804000 0.989112 O\n0.247919 0.196000 0.010888 O\n0.747919 0.696000 0.489112 O\n0.747919 0.304000 0.510888 O\n0.752082 0.196000 0.010888 O\n0.752082 0.804000 0.989112 O\n0.500000 0.941794 0.278796 O\n0.500000 0.058206 0.721204 O\n0.000000 0.441794 0.221204 O\n0.000000 0.558206 0.778796 O\n0.500000 0.453965 0.776392 O\n0.500000 0.546035 0.223608 O\n","nsites":40,"nelements":4,"elements":["Na","Li","Co","O"],"chemical_system":"Co-Li-Na-O","density":2.9701627741578824,"density_atomic":0.09427304088670191,"volume":424.299456385122,"volume_molar":6.387977626856713,"formula_full":"Na8 Li12 Co4 O16","formula_reduced":"Na2Li3CoO4","formula_anonymous":"AB2C3D4","energy_above_hull":1.4559892900000002,"spacegroup":58},{"id":"jvasp-20180","created_at":"2022-09-04T14:38:34.642245Z","updated_at":"2022-09-04T14:38:34.642260Z","structure_string":"Tl16 O24\n1.0\n8.761229 0.000000 -3.097562\n-4.380614 7.587447 -3.097562\n-0.000000 -0.000000 9.292686\nTl O\n16 24\ndirect\n0.250001 0.717737 0.467738 Tl\n0.500000 0.500000 0.500001 Tl\n0.000000 0.000000 0.500000 Tl\n0.500000 -0.000000 0.000000 Tl\n0.000000 0.500000 0.000000 Tl\n0.250000 0.217737 0.967737 Tl\n0.532264 0.750000 0.282264 Tl\n0.282264 0.532263 0.750001 Tl\n0.967737 0.250000 0.217737 Tl\n0.750000 0.282263 0.532264 Tl\n0.750001 0.782263 0.032264 Tl\n0.717737 0.467737 0.250001 Tl\n0.467737 0.250000 0.717737 Tl\n0.782263 0.032263 0.750001 Tl\n0.217738 0.967737 0.250001 Tl\n0.032264 0.750000 0.782264 Tl\n0.228671 0.457406 0.463410 O\n0.036591 0.493996 0.765261 O\n0.228735 0.271330 0.734740 O\n0.271265 0.006004 0.042595 O\n0.536591 0.771330 0.542595 O\n0.271330 0.734740 0.228736 O\n0.993997 0.957406 0.728736 O\n0.265261 0.771265 0.728671 O\n0.506004 0.234740 0.963410 O\n0.957406 0.728735 0.993997 O\n0.728671 0.265261 0.771265 O\n0.234740 0.963410 0.506005 O\n0.542595 0.536590 0.771330 O\n0.765261 0.036590 0.493996 O\n0.771330 0.542595 0.536591 O\n0.771265 0.728671 0.265261 O\n0.963410 0.506004 0.234740 O\n0.463410 0.228670 0.457406 O\n0.006004 0.042594 0.271265 O\n0.734740 0.228735 0.271330 O\n0.493996 0.765261 0.036591 O\n0.042595 0.271265 0.006004 O\n0.728736 0.993996 0.957407 O\n0.457406 0.463410 0.228671 O\n","nsites":40,"nelements":2,"elements":["Tl","O"],"chemical_system":"O-Tl","density":9.82267438182488,"density_atomic":0.06475272151820545,"volume":617.7346536508719,"volume_molar":9.300212591538497,"formula_full":"Tl16 O24","formula_reduced":"Tl2O3","formula_anonymous":"A2B3","energy_above_hull":1.11201114,"spacegroup":206},{"id":"jvasp-88429","created_at":"2022-09-04T14:36:09.823435Z","updated_at":"2022-09-04T14:36:09.823463Z","structure_string":"Yb16 O24\n1.0\n8.669876 -0.000000 -3.065264\n-4.334938 7.508333 -3.065264\n-0.000000 0.000000 9.195792\nYb O\n16 24\ndirect\n0.500000 0.500000 0.500000 Yb\n0.250000 0.719066 0.469066 Yb\n0.030933 0.750000 0.780934 Yb\n0.780934 0.030934 0.750000 Yb\n0.469066 0.250000 0.719066 Yb\n0.719066 0.469066 0.250000 Yb\n0.750000 0.280934 0.530934 Yb\n0.750000 0.780933 0.030934 Yb\n0.219066 0.969066 0.250000 Yb\n0.530934 0.750000 0.280934 Yb\n0.280934 0.530933 0.750000 Yb\n0.250000 0.219066 0.969066 Yb\n-0.000000 0.500000 0.000000 Yb\n0.500000 0.000000 0.000000 Yb\n0.969067 0.250000 0.219067 Yb\n0.000000 0.000000 0.500000 Yb\n0.962085 0.731131 0.992594 O\n0.537915 0.530508 0.769047 O\n0.238539 0.969492 0.507407 O\n0.730954 0.261460 0.768869 O\n0.030508 0.492593 0.761460 O\n0.992593 0.962085 0.731132 O\n0.231132 0.269046 0.738539 O\n0.268869 0.007407 0.037915 O\n0.230953 0.462085 0.469492 O\n0.462085 0.469492 0.230954 O\n0.761461 0.030508 0.492593 O\n0.269046 0.738539 0.231132 O\n0.037915 0.268868 0.007407 O\n0.261460 0.768868 0.730954 O\n0.492593 0.761460 0.030509 O\n0.007407 0.037915 0.268868 O\n0.469492 0.230953 0.462085 O\n0.969492 0.507407 0.238540 O\n0.768869 0.730953 0.261461 O\n0.731131 0.992593 0.962085 O\n0.769047 0.537915 0.530509 O\n0.530508 0.769046 0.537915 O\n0.738540 0.231131 0.269047 O\n0.507407 0.238539 0.969492 O\n","nsites":40,"nelements":2,"elements":["Yb","O"],"chemical_system":"O-Yb","density":8.745324808389974,"density_atomic":0.06682122609959718,"volume":598.6121826076629,"volume_molar":9.012317060785426,"formula_full":"Yb16 O24","formula_reduced":"Yb2O3","formula_anonymous":"A2B3","energy_above_hull":1.7107487,"spacegroup":206},{"id":"jvasp-23637","created_at":"2022-09-04T14:37:42.246156Z","updated_at":"2022-09-04T14:37:42.246173Z","structure_string":"Hf10 Ga20 Co10\n1.0\n7.322960 -0.000000 3.439651\n3.661480 8.648236 1.719825\n-0.015270 0.000000 9.547564\nHf Ga Co\n10 20 10\ndirect\n0.404114 0.719775 0.719775 Hf\n0.517860 0.000000 -0.000000 Hf\n0.054112 0.000000 -0.000000 Hf\n0.836395 0.000000 0.599220 Hf\n0.435616 0.400780 0.000000 Hf\n0.123889 0.280225 0.719775 Hf\n0.435616 0.000000 0.400780 Hf\n0.843665 0.280225 0.280225 Hf\n0.123889 0.719775 0.280225 Hf\n0.836394 0.599220 0.000000 Hf\n0.737749 0.508113 0.789369 Ga\n0.959877 0.838683 0.838683 Ga\n0.035231 0.210630 0.491887 Ga\n0.737749 0.789370 0.508113 Ga\n0.527119 0.508113 0.210630 Ga\n0.245862 0.491888 0.789369 Ga\n0.035231 0.491888 0.210631 Ga\n0.245862 0.789370 0.491888 Ga\n0.527119 0.210630 0.508112 Ga\n0.798560 0.161317 0.838683 Ga\n0.160571 0.260898 0.000000 Ga\n0.160572 0.000000 0.260897 Ga\n0.265003 0.384124 0.384123 Ga\n0.649126 0.615877 0.384124 Ga\n0.421468 0.000000 0.739102 Ga\n0.649126 0.384124 0.615876 Ga\n0.033249 0.615877 0.615877 Ga\n0.637243 0.161317 0.161317 Ga\n0.798560 0.838683 0.161317 Ga\n0.421468 0.739103 0.000000 Ga\n0.899346 0.500000 0.500000 Co\n0.399346 0.500000 0.500000 Co\n0.144557 0.000000 0.674810 Co\n0.819367 0.325190 0.000000 Co\n0.488936 0.215696 0.784304 Co\n0.273240 0.215696 0.215696 Co\n0.488936 0.784305 0.215696 Co\n0.704632 0.784305 0.784304 Co\n0.144557 0.674810 0.000000 Co\n0.819367 0.000000 0.325190 Co\n","nsites":40,"nelements":3,"elements":["Hf","Ga","Co"],"chemical_system":"Co-Ga-Hf","density":10.342054720465487,"density_atomic":0.06610390036870877,"volume":605.1080159701828,"volume_molar":9.110114117941922,"formula_full":"Hf10 Ga20 Co10","formula_reduced":"HfGa2Co","formula_anonymous":"ABC2","energy_above_hull":1.8456021375,"spacegroup":107},{"id":"jvasp-97563","created_at":"2022-09-04T14:36:19.845849Z","updated_at":"2022-09-04T14:36:19.845870Z","structure_string":"Li12 H24 Ir4\n1.0\n8.490002 -0.000000 0.000000\n-0.000000 4.751497 0.000000\n0.000000 0.000000 8.469586\nLi H Ir\n12 24 4\ndirect\n0.541478 0.250000 0.869924 Li\n0.771424 0.750000 0.758371 Li\n0.271424 0.750000 0.741630 Li\n0.228576 0.250000 0.241629 Li\n0.602642 0.750000 0.478232 Li\n0.102642 0.750000 0.021768 Li\n0.728576 0.250000 0.258371 Li\n0.897358 0.250000 0.978233 Li\n0.958521 0.750000 0.369923 Li\n0.458522 0.750000 0.130077 Li\n0.041478 0.250000 0.630077 Li\n0.397358 0.250000 0.521768 Li\n0.387414 0.750000 0.559347 H\n0.105140 0.495566 0.820801 H\n0.612586 0.250000 0.440654 H\n0.112586 0.250000 0.059347 H\n0.887414 0.750000 0.940654 H\n0.225879 0.250000 0.896994 H\n0.334526 0.250000 0.733940 H\n0.165473 0.750000 0.233940 H\n0.665473 0.750000 0.266060 H\n0.725879 0.250000 0.603007 H\n0.605140 0.004434 0.679200 H\n0.834526 0.250000 0.766061 H\n0.894859 0.995566 0.179199 H\n0.346030 0.498634 0.971173 H\n0.894859 0.504434 0.179199 H\n0.394860 0.995566 0.320801 H\n0.105140 0.004434 0.820801 H\n0.605140 0.495566 0.679200 H\n0.274121 0.750000 0.396994 H\n0.846030 0.001366 0.528828 H\n0.653969 -0.001366 0.028827 H\n0.153970 0.501367 0.471173 H\n0.653969 0.501367 0.028827 H\n0.153970 -0.001366 0.471173 H\n0.346030 0.001366 0.971173 Ir\n0.846030 0.498634 0.528828 Ir\n0.394860 0.504434 0.320801 Ir\n0.774121 0.750000 0.103007 Ir\n","nsites":40,"nelements":3,"elements":["Li","H","Ir"],"chemical_system":"H-Ir-Li","density":4.259185270107273,"density_atomic":0.11707375746239498,"volume":341.6649543587795,"volume_molar":5.143886119768864,"formula_full":"Li12 H24 Ir4","formula_reduced":"Li3H6Ir","formula_anonymous":"AB3C6","energy_above_hull":2.60230811,"spacegroup":1},{"id":"jvasp-99036","created_at":"2022-09-04T14:36:32.077515Z","updated_at":"2022-09-04T14:36:32.077537Z","structure_string":"In6 Sb10 O24\n1.0\n8.703867 0.022244 -3.090917\n-4.384089 7.519146 -3.090917\n0.012741 0.022244 9.236390\nIn Sb O\n6 10 24\ndirect\n0.247727 0.747710 0.497716 In\n0.247727 0.497716 0.747710 In\n0.497717 0.747710 0.247727 In\n0.747710 0.247727 0.497716 In\n0.747710 0.497716 0.247727 In\n0.497717 0.247727 0.747710 In\n0.516614 0.516614 0.516613 Sb\n0.279463 0.997698 0.279462 Sb\n0.997710 0.997710 0.478811 Sb\n0.997710 0.478811 0.997709 Sb\n0.997727 0.715987 0.715987 Sb\n0.715987 0.715987 0.997726 Sb\n0.715988 0.997727 0.715987 Sb\n0.997698 0.279462 0.279462 Sb\n0.478811 0.997710 0.997710 Sb\n0.279462 0.279462 0.997697 Sb\n0.700110 0.700110 0.204893 O\n0.295338 0.502511 0.997710 O\n0.502512 0.997710 0.295337 O\n0.204894 0.700110 0.700110 O\n0.520981 0.997716 0.795745 O\n0.790538 0.492946 0.492946 O\n0.997716 0.795746 0.520981 O\n0.795746 0.520981 0.997715 O\n0.795746 0.997716 0.520981 O\n0.997716 0.520981 0.795745 O\n0.520981 0.795746 0.997715 O\n0.722941 0.199711 0.199711 O\n0.199712 0.199711 0.722941 O\n0.492946 0.790538 0.492946 O\n0.199712 0.722942 0.199712 O\n0.474464 0.474463 0.272476 O\n0.474464 0.272476 0.474463 O\n0.502511 0.295337 0.997710 O\n0.295338 0.997710 0.502511 O\n0.997710 0.502511 0.295337 O\n0.997710 0.295337 0.502511 O\n0.492946 0.492946 0.790538 O\n0.272476 0.474463 0.474463 O\n0.700110 0.204893 0.700110 O\n","nsites":40,"nelements":3,"elements":["In","Sb","O"],"chemical_system":"In-O-Sb","density":6.270353109501183,"density_atomic":0.06594377570558449,"volume":606.5773391348681,"volume_molar":9.132235295241081,"formula_full":"In6 Sb10 O24","formula_reduced":"In3Sb5O12","formula_anonymous":"A3B5C12","energy_above_hull":2.1673766205,"spacegroup":217},{"id":"jvasp-90899","created_at":"2022-09-04T14:35:56.482693Z","updated_at":"2022-09-04T14:35:56.482709Z","structure_string":"K4 Si8 B4 O24\n1.0\n4.726590 0.000000 0.000000\n0.000000 10.010161 0.000000\n0.000000 0.000000 10.503931\nK Si B O\n4 8 4 24\ndirect\n0.801303 0.966851 0.811881 K\n0.698697 0.033148 0.311881 K\n0.301303 0.533148 0.188119 K\n0.198697 0.466852 0.688119 K\n0.789058 0.608503 0.934498 Si\n0.710942 0.391497 0.434498 Si\n0.289058 0.891497 0.065502 Si\n0.210942 0.108503 0.565502 Si\n0.266856 0.801381 0.576021 Si\n0.233144 0.198619 0.076022 Si\n0.766856 0.698619 0.423978 Si\n0.733144 0.301381 0.923978 Si\n0.707394 0.231831 0.657520 B\n0.792606 0.768169 0.157520 B\n0.207394 0.268169 0.342480 B\n0.292606 0.731831 0.842480 B\n0.380617 0.050685 0.081877 O\n0.119383 0.949315 0.581877 O\n0.975004 0.193638 0.971069 O\n0.524996 0.806362 0.471069 O\n0.475004 0.306362 0.028931 O\n0.024996 0.693638 0.528931 O\n0.606268 0.254482 0.788940 O\n0.893732 0.745518 0.288940 O\n0.106268 0.245518 0.211060 O\n0.393732 0.754482 0.711060 O\n0.545440 0.119885 0.602847 O\n0.011702 0.197059 0.660033 O\n0.045440 0.380115 0.397153 O\n0.454560 0.619885 0.897153 O\n0.662869 0.357553 0.585525 O\n0.837131 0.642447 0.085525 O\n0.162869 0.142447 0.414475 O\n0.337131 0.857553 0.914475 O\n0.619383 0.550685 0.418123 O\n0.488298 0.802941 0.160033 O\n0.511702 0.302941 0.339967 O\n0.988298 0.697059 0.839967 O\n0.954560 0.880115 0.102847 O\n0.880617 0.449315 0.918123 O\n","nsites":40,"nelements":4,"elements":["K","Si","B","O"],"chemical_system":"B-K-O-Si","density":2.7007505626542434,"density_atomic":0.0804857762006884,"volume":496.9822232969641,"volume_molar":7.482242259780172,"formula_full":"K4 Si8 B4 O24","formula_reduced":"KSi2BO6","formula_anonymous":"ABC2D6","energy_above_hull":2.630009878333333,"spacegroup":19},{"id":"jvasp-98309","created_at":"2022-09-04T14:36:19.375294Z","updated_at":"2022-09-04T14:36:19.375318Z","structure_string":"Na8 P8 O24\n1.0\n5.607361 0.000000 1.784793\n2.803680 9.294104 0.892396\n-0.015234 0.000000 9.748700\nNa P O\n8 8 24\ndirect\n0.516336 0.268756 0.555749 Na\n0.714908 0.444250 0.768756 Na\n0.927915 0.055749 0.731243 Na\n0.072086 0.944250 0.268757 Na\n0.285093 0.555749 0.231244 Na\n0.340843 0.231243 0.944250 Na\n0.659158 0.768756 0.055750 Na\n0.483664 0.731243 0.444251 Na\n0.499407 0.059297 0.293787 P\n0.852491 0.440703 0.206213 P\n0.147509 0.559297 0.793787 P\n0.058704 0.293787 0.440703 P\n0.793194 0.206213 0.059297 P\n0.941296 0.706213 0.559297 P\n0.500594 0.940702 0.706213 P\n0.206807 0.793787 0.940703 P\n0.882648 0.582387 0.881542 O\n0.117352 0.417612 0.118458 O\n0.562405 0.141984 0.139456 O\n0.678195 0.589694 0.238694 O\n0.493417 0.089695 0.738694 O\n-0.034964 0.881542 0.917613 O\n0.156156 0.641984 0.639456 O\n0.437596 0.858015 0.860544 O\n0.767890 0.238694 0.910305 O\n0.764190 0.618457 0.582388 O\n0.204389 0.139456 0.358016 O\n0.034965 0.118458 0.082388 O\n0.346578 0.917612 0.618458 O\n0.298140 0.639456 0.858016 O\n0.083112 0.738694 0.410306 O\n0.701861 0.360544 0.141984 O\n0.235810 0.381542 0.417612 O\n0.653423 0.082388 0.381542 O\n0.843845 0.358016 0.360544 O\n0.321806 0.410305 0.761306 O\n0.916889 0.261306 0.589694 O\n0.506584 0.910305 0.261306 O\n0.232111 0.761306 0.089695 O\n0.795612 0.860544 0.641984 O\n","nsites":40,"nelements":3,"elements":["Na","P","O"],"chemical_system":"Na-O-P","density":2.6646954183022156,"density_atomic":0.07869212642643833,"volume":508.31006628588364,"volume_molar":7.652786922246303,"formula_full":"Na8 P8 O24","formula_reduced":"NaPO3","formula_anonymous":"ABC3","energy_above_hull":1.557137,"spacegroup":88},{"id":"jvasp-96999","created_at":"2022-09-04T14:36:04.253595Z","updated_at":"2022-09-04T14:36:04.253628Z","structure_string":"Ho4 Sn6 Pb6 S24\n1.0\n3.926752 0.000000 0.000000\n0.000000 11.606761 0.000000\n0.000000 0.000000 20.335538\nHo Sn Pb S\n4 6 6 24\ndirect\n0.000000 0.866919 0.106694 Ho\n0.000000 0.366919 0.893306 Ho\n0.000000 0.551467 0.411869 Ho\n0.000000 0.051467 0.588131 Ho\n0.500000 0.674899 0.909842 Sn\n0.500000 0.692437 0.249463 Sn\n0.500000 0.203354 0.428684 Sn\n0.500000 0.192438 0.750537 Sn\n0.500000 0.703354 0.571316 Sn\n0.500000 0.174899 0.090158 Sn\n0.000000 0.424488 0.620919 Pb\n0.000000 0.924488 0.379081 Pb\n0.000000 0.787388 0.738126 Pb\n0.000000 0.989386 0.916036 Pb\n0.000000 0.287388 0.261874 Pb\n0.000000 0.489386 0.083965 Pb\n0.500000 0.978480 0.032817 S\n0.000000 0.255443 0.497559 S\n0.000000 0.345903 0.757158 S\n0.500000 0.357573 0.159587 S\n0.000000 0.547341 0.262587 S\n0.000000 0.091064 0.160793 S\n0.500000 0.597290 0.676607 S\n0.500000 0.511147 0.508968 S\n0.000000 0.845903 0.242842 S\n0.500000 0.011147 0.491032 S\n0.500000 0.714222 0.373978 S\n0.500000 0.214222 0.626022 S\n0.000000 0.755443 0.502441 S\n0.000000 0.756944 0.982466 S\n0.500000 0.857573 0.840413 S\n0.000000 0.256944 0.017534 S\n0.500000 0.700759 0.123697 S\n0.000000 0.591064 0.839207 S\n0.500000 0.478480 0.967184 S\n0.500000 0.392697 0.363059 S\n0.500000 0.097290 0.323393 S\n0.500000 0.892697 0.636941 S\n0.500000 0.200759 0.876303 S\n0.000000 0.047341 0.737413 S\n","nsites":40,"nelements":4,"elements":["Ho","Sn","Pb","S"],"chemical_system":"Ho-Pb-S-Sn","density":6.064212251365692,"density_atomic":0.043157850798996464,"volume":926.8302118726011,"volume_molar":13.953754991293566,"formula_full":"Ho4 Sn6 Pb6 S24","formula_reduced":"Ho2Sn3(PbS4)3","formula_anonymous":"A2B3C3D12","energy_above_hull":1.692429434666667,"spacegroup":26},{"id":"jvasp-99086","created_at":"2022-09-04T14:36:09.737499Z","updated_at":"2022-09-04T14:36:09.737517Z","structure_string":"Ba8 Na2 Ru6 O24\n1.0\n5.832126 -0.000000 0.000000\n-2.916062 5.050769 -0.000000\n0.000000 -0.000000 19.224905\nBa Na Ru O\n8 2 6 24\ndirect\n0.000000 0.000000 0.116816 Ba\n0.000000 0.000000 0.616816 Ba\n0.333334 0.666667 0.372583 Ba\n0.666668 0.333333 0.872583 Ba\n0.666668 0.333333 0.496825 Ba\n0.333334 0.666667 0.996825 Ba\n0.333334 0.666667 0.745785 Ba\n0.666668 0.333333 0.245785 Ba\n0.666668 0.333333 0.059444 Na\n0.333334 0.666667 0.559445 Na\n0.333334 0.666667 0.183671 Ru\n0.666668 0.333333 0.683672 Ru\n0.000000 0.000000 0.434756 Ru\n0.000000 0.000000 0.799869 Ru\n0.000000 0.000000 0.299868 Ru\n0.000000 0.000000 0.934757 Ru\n0.155926 0.311852 0.488358 O\n0.513249 0.026498 0.628268 O\n0.486752 0.973502 0.128268 O\n0.026499 0.513249 0.128268 O\n0.513249 0.486751 0.628268 O\n0.844075 0.688148 0.988358 O\n0.155927 0.844074 0.488358 O\n0.688149 0.844074 0.488358 O\n0.311852 0.155926 0.988358 O\n0.844075 0.155926 0.988358 O\n0.691367 0.845683 0.864677 O\n0.668409 0.834204 0.244775 O\n0.845684 0.154317 0.364677 O\n0.154317 0.845683 0.864677 O\n0.154317 0.308634 0.864677 O\n0.308634 0.154317 0.364677 O\n0.834205 0.668408 0.744775 O\n0.165797 0.834204 0.244775 O\n0.973503 0.486751 0.628268 O\n0.331592 0.165796 0.744775 O\n0.834204 0.165796 0.744775 O\n0.165797 0.331592 0.244775 O\n0.845684 0.691366 0.364677 O\n0.486752 0.513249 0.128268 O\n","nsites":40,"nelements":4,"elements":["Ba","Na","Ru","O"],"chemical_system":"Ba-Na-O-Ru","density":6.260349819647508,"density_atomic":0.07063360698573597,"volume":566.3026667755727,"volume_molar":8.525885930214685,"formula_full":"Ba8 Na2 Ru6 O24","formula_reduced":"Ba4Na(RuO4)3","formula_anonymous":"AB3C4D12","energy_above_hull":2.470446819,"spacegroup":186},{"id":"jvasp-20899","created_at":"2022-09-04T14:37:40.369861Z","updated_at":"2022-09-04T14:37:40.369881Z","structure_string":"Mg8 B16 C16\n1.0\n7.215864 0.001461 0.000000\n-1.028347 7.142212 -0.000000\n0.000000 -0.000000 7.428011\nMg B C\n8 16 16\ndirect\n0.152843 0.847156 0.000000 Mg\n0.847156 0.152843 0.000000 Mg\n0.652843 0.347156 0.500000 Mg\n0.279754 0.279754 0.989461 Mg\n0.220246 0.220246 0.489461 Mg\n0.779753 0.779754 0.510539 Mg\n0.720245 0.720245 0.010539 Mg\n0.347156 0.652843 0.500000 Mg\n0.411733 0.411733 0.724723 B\n0.088267 0.088267 0.224723 B\n0.911732 0.911733 0.775277 B\n0.588266 0.588266 0.275277 B\n0.531495 0.786827 0.755579 B\n0.655774 0.155774 0.750000 B\n0.155774 0.655774 0.750000 B\n0.344225 0.844225 0.250000 B\n0.213172 0.468504 0.244421 B\n0.286827 0.031496 0.744421 B\n0.968503 0.713172 0.255579 B\n0.468504 0.213173 0.244421 B\n0.786827 0.531496 0.755579 B\n0.713172 0.968504 0.255579 B\n0.031496 0.286827 0.744421 B\n0.844225 0.344225 0.250000 B\n0.079336 0.079336 0.768297 C\n0.420664 0.420664 0.268297 C\n0.579335 0.579336 0.731703 C\n0.920663 0.920664 0.231703 C\n0.823285 0.323285 0.750000 C\n0.323285 0.823285 0.750000 C\n0.176714 0.676715 0.250000 C\n0.449885 0.200926 0.724270 C\n0.799073 0.550115 0.275730 C\n0.700926 0.949885 0.775729 C\n0.050115 0.299073 0.224270 C\n0.550114 0.799073 0.275730 C\n0.200926 0.449885 0.724270 C\n0.299073 0.050115 0.224270 C\n0.676714 0.176715 0.250000 C\n0.949884 0.700926 0.775729 C\n","nsites":40,"nelements":3,"elements":["Mg","B","C"],"chemical_system":"B-C-Mg","density":2.427228117224982,"density_atomic":0.10448494449915928,"volume":382.8302746557123,"volume_molar":5.7636445029154,"formula_full":"Mg8 B16 C16","formula_reduced":"Mg(BC)2","formula_anonymous":"AB2C2","energy_above_hull":4.247038843333334,"spacegroup":64},{"id":"jvasp-96605","created_at":"2022-09-04T14:36:10.267767Z","updated_at":"2022-09-04T14:36:10.267797Z","structure_string":"Na8 H8 N8 O16\n1.0\n6.361084 -0.000073 -0.000157\n-0.000112 9.688129 -0.000165\n-0.000168 -0.000114 6.667072\nNa H N O\n8 8 8 16\ndirect\n0.000000 0.500000 0.500001 Na\n0.000001 0.500000 0.000001 Na\n-0.000000 0.000000 0.500000 Na\n0.999998 0.000001 -0.000001 Na\n0.327801 0.250002 0.500004 Na\n0.672201 0.750001 0.999996 Na\n0.672198 0.749998 0.499996 Na\n0.327798 0.250001 0.000004 Na\n0.820338 0.277396 0.106784 H\n0.179668 0.722613 0.606786 H\n0.820332 0.222608 0.893212 H\n0.179661 0.777392 0.393217 H\n0.179669 0.777395 0.106789 H\n0.820331 0.277388 0.393211 H\n0.820338 0.222609 0.606780 H\n0.179659 0.722607 0.893217 H\n0.612511 0.025568 0.249991 N\n0.612510 0.474436 0.749991 N\n0.387489 0.525566 0.250010 N\n0.387487 0.974434 0.750007 N\n0.425331 0.526128 0.750005 N\n0.574665 0.473872 0.249996 N\n0.425335 0.973871 0.250005 N\n0.574667 0.026129 0.749994 N\n0.078542 0.749999 -0.000001 O\n0.921456 0.250001 0.500000 O\n0.764014 0.571176 0.749989 O\n0.235986 0.428825 0.250012 O\n0.764013 0.928828 0.249989 O\n0.235985 0.071173 0.750009 O\n0.391994 0.661308 0.750013 O\n0.608006 0.338693 0.249987 O\n0.391989 0.838692 0.250013 O\n0.608009 0.161309 0.749986 O\n0.262169 0.441346 0.750010 O\n0.737831 0.558655 0.249991 O\n0.262172 0.058651 0.250009 O\n0.737827 0.941349 0.749990 O\n0.078542 0.749998 0.500004 O\n0.921457 0.250003 0.999997 O\n","nsites":40,"nelements":4,"elements":["Na","H","N","O"],"chemical_system":"H-N-Na-O","density":2.2633454614934068,"density_atomic":0.09735400064168855,"volume":410.8716615275013,"volume_molar":6.185817450034223,"formula_full":"Na8 H8 N8 O16","formula_reduced":"NaHNO2","formula_anonymous":"ABCD2","energy_above_hull":2.34107385,"spacegroup":57}]}