{"count":1013513,"next":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=-updated_at&page=12","previous":"https://simmate.org/third-parties/OqmdStructure/?format=json&ordering=-updated_at&page=10","results":[{"id":"oqmd-1759366","created_at":"2022-09-04T16:03:17.546407Z","updated_at":"2022-09-04T16:03:17.546434Z","structure_string":"Rb4 Zn4 H12\n1.0\n6.947652 0.000000 0.000000\n0.000000 5.864155 0.000000\n-1.902330 0.000000 9.190721\nH Rb Zn\n12 4 4\ndirect\n0.330789 0.017818 0.081706 H\n0.344712 0.492711 0.084937 H\n0.882492 0.732412 0.151299 H\n0.117508 0.232412 0.348701 H\n0.655288 0.992711 0.415063 H\n0.669211 0.517818 0.418294 H\n0.330789 0.482182 0.581706 H\n0.344712 0.007289 0.584937 H\n0.882492 0.767588 0.651299 H\n0.117508 0.267588 0.848701 H\n0.655288 0.507289 0.915063 H\n0.669211 0.982182 0.918294 H\n0.739147 0.245520 0.192406 Rb\n0.260853 0.745520 0.307594 Rb\n0.739147 0.254480 0.692406 Rb\n0.260853 0.754480 0.807594 Rb\n0.258401 0.258773 0.008403 Zn\n0.741599 0.758773 0.491597 Zn\n0.258401 0.241227 0.508403 Zn\n0.741599 0.741227 0.991597 Zn\n","nsites":20,"nelements":3,"elements":["H","Rb","Zn"],"chemical_system":"H-Rb-Zn","density":2.7299605908566256,"density_atomic":0.05341176323094979,"volume":374.4493495472337,"volume_molar":11.274933452319416,"formula_full":"Rb4 Zn4 H12","formula_reduced":"RbZnH3","formula_anonymous":"ABC3","formation_energy":-0.0638204138105049,"spacegroup":14},{"id":"oqmd-1753188","created_at":"2022-09-04T16:03:17.545898Z","updated_at":"2022-09-04T16:03:17.545926Z","structure_string":"Li4 Pr2 Si2 O10\n1.0\n6.967778 0.000000 0.000000\n0.000000 6.967778 0.000000\n0.000000 0.000000 4.634280\nLi O Pr Si\n4 10 2 2\ndirect\n0.250000 0.250000 0.500000 Li\n0.750000 0.250000 0.500000 Li\n0.250000 0.750000 0.500000 Li\n0.750000 0.750000 0.500000 Li\n0.183526 0.000000 0.219937 O\n0.816474 0.000000 0.219937 O\n0.500000 0.316474 0.219937 O\n0.500000 0.683526 0.219937 O\n0.000000 0.500000 0.400951 O\n0.500000 0.000000 0.599049 O\n0.000000 0.183526 0.780063 O\n0.316474 0.500000 0.780063 O\n0.683526 0.500000 0.780063 O\n0.000000 0.816474 0.780063 O\n0.500000 0.000000 0.070678 Pr\n0.000000 0.500000 0.929322 Pr\n0.000000 0.000000 0.000000 Si\n0.500000 0.500000 0.000000 Si\n","nsites":18,"nelements":4,"elements":["Li","O","Pr","Si"],"chemical_system":"Li-O-Pr-Si","density":3.880188194005127,"density_atomic":0.08000214377558745,"volume":224.99397079272615,"volume_molar":7.527474234806253,"formula_full":"Li4 Pr2 Si2 O10","formula_reduced":"Li2PrSiO5","formula_anonymous":"ABC2D5","formation_energy":-2.6203862524326413,"spacegroup":129},{"id":"oqmd-1759425","created_at":"2022-09-04T16:03:17.544536Z","updated_at":"2022-09-04T16:03:17.544552Z","structure_string":"K4 Sr4 F12\n1.0\n6.138727 0.000000 0.000000\n0.000000 8.727584 0.000000\n-0.014339 0.000000 6.381577\nF K Sr\n12 4 4\ndirect\n0.368168 0.250000 0.056193 F\n0.814252 0.065709 0.190590 F\n0.814252 0.434291 0.190590 F\n0.314476 0.565103 0.309579 F\n0.314476 0.934897 0.309579 F\n0.868353 0.750000 0.442896 F\n0.131647 0.250000 0.557104 F\n0.685524 0.065103 0.690421 F\n0.685524 0.434897 0.690421 F\n0.185748 0.565709 0.809410 F\n0.185748 0.934291 0.809410 F\n0.631832 0.750000 0.943807 F\n0.020225 0.750000 0.067441 K\n0.519703 0.250000 0.432727 K\n0.480297 0.750000 0.567273 K\n0.979775 0.250000 0.932559 K\n0.500000 0.000000 0.000000 Sr\n0.500000 0.500000 0.000000 Sr\n0.000000 0.000000 0.500000 Sr\n0.000000 0.500000 0.500000 Sr\n","nsites":20,"nelements":3,"elements":["F","K","Sr"],"chemical_system":"F-K-Sr","density":3.56902681924765,"density_atomic":0.05849646532786071,"volume":341.90100013571924,"volume_molar":10.2948797440104,"formula_full":"K4 Sr4 F12","formula_reduced":"KSrF3","formula_anonymous":"ABC3","formation_energy":-3.617861492978664,"spacegroup":62},{"id":"oqmd-1732826","created_at":"2022-09-04T16:03:17.543016Z","updated_at":"2022-09-04T16:03:17.543044Z","structure_string":"Ru8 C6\n1.0\n-3.430595 3.430595 3.430595\n3.430595 -3.430595 3.430595\n3.430595 3.430595 -3.430595\nC Ru\n6 8\ndirect\n0.750000 0.875000 0.125000 C\n0.625000 0.375000 0.250000 C\n0.250000 0.625000 0.375000 C\n0.375000 0.250000 0.625000 C\n0.875000 0.125000 0.750000 C\n0.125000 0.750000 0.875000 C\n0.465531 0.500000 0.000000 Ru\n0.965531 0.500000 0.000000 Ru\n0.034469 0.034469 0.034469 Ru\n0.500000 0.000000 0.465531 Ru\n0.000000 0.465531 0.500000 Ru\n0.000000 0.965531 0.500000 Ru\n0.534469 0.534469 0.534469 Ru\n0.500000 0.000000 0.965531 Ru\n","nsites":14,"nelements":2,"elements":["C","Ru"],"chemical_system":"C-Ru","density":9.054643817305351,"density_atomic":0.08668814173588295,"volume":161.49844395851156,"volume_molar":6.946902585993773,"formula_full":"Ru8 C6","formula_reduced":"Ru4C3","formula_anonymous":"A3B4","formation_energy":0.548262961785713,"spacegroup":220},{"id":"oqmd-1759291","created_at":"2022-09-04T16:03:17.538531Z","updated_at":"2022-09-04T16:03:17.538558Z","structure_string":"Li2 Ho4 Ir2 O12\n1.0\n5.236549 0.000000 0.000000\n0.000000 5.684211 0.000000\n-5.107150 0.000000 7.517475\nHo Ir Li O\n4 2 2 12\ndirect\n0.722808 0.916579 0.247273 Ho\n0.277192 0.416579 0.252727 Ho\n0.722808 0.583421 0.747273 Ho\n0.277192 0.083421 0.752727 Ho\n0.000000 0.000000 0.000000 Ir\n0.000000 0.500000 0.500000 Ir\n0.500000 0.500000 0.000000 Li\n0.500000 0.000000 0.500000 Li\n0.369743 0.185091 0.057448 O\n0.234509 0.701610 0.062329 O\n0.125516 0.041982 0.248395 O\n0.874484 0.541982 0.251605 O\n0.765491 0.201610 0.437671 O\n0.630257 0.685091 0.442552 O\n0.369743 0.314909 0.557448 O\n0.234509 0.798390 0.562329 O\n0.125516 0.458018 0.748395 O\n0.874484 0.958018 0.751605 O\n0.765491 0.298390 0.937671 O\n0.630257 0.814909 0.942552 O\n","nsites":20,"nelements":4,"elements":["Ho","Ir","Li","O"],"chemical_system":"Ho-Ir-Li-O","density":9.27645850551895,"density_atomic":0.08938047137848043,"volume":223.762525432544,"volume_molar":6.7376471248393,"formula_full":"Li2 Ho4 Ir2 O12","formula_reduced":"LiHo2IrO6","formula_anonymous":"ABC2D6","formation_energy":-2.625936987693919,"spacegroup":14},{"id":"oqmd-1759382","created_at":"2022-09-04T16:03:17.535287Z","updated_at":"2022-09-04T16:03:17.535317Z","structure_string":"Na4 Cr4 H12\n1.0\n5.099760 0.000000 0.000000\n0.000000 7.212875 0.000000\n0.000000 0.000000 5.100904\nCr H Na\n4 12 4\ndirect\n0.000000 0.000000 0.000000 Cr\n0.000000 0.500000 0.000000 Cr\n0.500000 0.000000 0.500000 Cr\n0.500000 0.500000 0.500000 Cr\n0.999334 0.250000 0.006818 H\n0.251057 0.503315 0.249042 H\n0.251057 0.996685 0.249042 H\n0.751057 0.503315 0.250958 H\n0.751057 0.996685 0.250958 H\n0.499334 0.250000 0.493182 H\n0.500666 0.750000 0.506818 H\n0.248943 0.003315 0.749042 H\n0.248943 0.496685 0.749042 H\n0.748943 0.003315 0.750958 H\n0.748943 0.496685 0.750958 H\n0.000666 0.750000 0.993182 H\n0.499527 0.250000 0.000000 Na\n0.500473 0.750000 0.000000 Na\n0.000473 0.750000 0.500000 Na\n0.999527 0.250000 0.500000 Na\n","nsites":20,"nelements":3,"elements":["Cr","H","Na"],"chemical_system":"Cr-H-Na","density":2.7615463868728365,"density_atomic":0.10659202219786586,"volume":187.63130286499464,"volume_molar":5.649710584175945,"formula_full":"Na4 Cr4 H12","formula_reduced":"NaCrH3","formula_anonymous":"ABC3","formation_energy":-0.0333885209808343,"spacegroup":221},{"id":"oqmd-1759289","created_at":"2022-09-04T16:03:17.535191Z","updated_at":"2022-09-04T16:03:17.535217Z","structure_string":"Li2 Nd4 Nb2 O12\n1.0\n5.469551 0.000000 0.000000\n0.000000 5.794354 0.000000\n-5.353327 0.000000 7.782997\nLi Nb Nd O\n2 2 4 12\ndirect\n0.500000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.500000 0.000000 Nb\n0.000000 0.000000 0.500000 Nb\n0.731985 0.566325 0.248279 Nd\n0.268015 0.066325 0.251721 Nd\n0.731985 0.933675 0.748279 Nd\n0.268015 0.433675 0.751721 Nd\n0.349251 0.313450 0.050510 O\n0.239856 0.791912 0.056583 O\n0.140912 0.463620 0.246026 O\n0.859088 0.963620 0.253974 O\n0.760144 0.291912 0.443417 O\n0.650749 0.813450 0.449490 O\n0.349251 0.186550 0.550510 O\n0.239856 0.708088 0.556583 O\n0.140912 0.036380 0.746026 O\n0.859088 0.536380 0.753974 O\n0.760144 0.208088 0.943417 O\n0.650749 0.686550 0.949490 O\n","nsites":20,"nelements":4,"elements":["Li","Nb","Nd","O"],"chemical_system":"Li-Nb-Nd-O","density":6.521010648548274,"density_atomic":0.08108236954028865,"volume":246.66274694972117,"volume_molar":7.4271889118974075,"formula_full":"Li2 Nd4 Nb2 O12","formula_reduced":"LiNd2NbO6","formula_anonymous":"ABC2D6","formation_energy":-3.214197939527253,"spacegroup":14},{"id":"oqmd-1759365","created_at":"2022-09-04T16:03:17.535105Z","updated_at":"2022-09-04T16:03:17.535120Z","structure_string":"Cs4 Be4 H12\n1.0\n6.654165 0.000000 0.000000\n0.000000 5.940182 0.000000\n-1.433075 0.000000 9.379866\nBe Cs H\n4 4 12\ndirect\n0.753547 0.255789 0.014197 Be\n0.246453 0.755789 0.485803 Be\n0.753547 0.244211 0.514197 Be\n0.246453 0.744211 0.985803 Be\n0.252375 0.245867 0.183614 Cs\n0.747625 0.745867 0.316386 Cs\n0.252375 0.254133 0.683614 Cs\n0.747625 0.754133 0.816386 Cs\n0.820676 0.459370 0.079442 H\n0.813860 0.051980 0.082746 H\n0.366285 0.744496 0.120841 H\n0.633715 0.244496 0.379159 H\n0.186140 0.551980 0.417254 H\n0.179324 0.959370 0.420558 H\n0.820676 0.040630 0.579442 H\n0.813860 0.448020 0.582746 H\n0.366285 0.755504 0.620841 H\n0.633715 0.255504 0.879159 H\n0.186140 0.948020 0.917254 H\n0.179324 0.540630 0.920558 H\n","nsites":20,"nelements":3,"elements":["Be","Cs","H"],"chemical_system":"Be-Cs-H","density":2.5966400481403666,"density_atomic":0.0539436146719872,"volume":370.75750525086625,"volume_molar":11.163769422235777,"formula_full":"Cs4 Be4 H12","formula_reduced":"CsBeH3","formula_anonymous":"ABC3","formation_energy":-0.0994752718105054,"spacegroup":14},{"id":"oqmd-1731844","created_at":"2022-09-04T16:03:17.529798Z","updated_at":"2022-09-04T16:03:17.529817Z","structure_string":"Pr2 Cr2 Se2 O12\n1.0\n5.044251 0.000000 0.000000\n-2.522125 4.368449 0.000000\n0.000000 0.000000 10.058292\nCr O Pr Se\n2 12 2 2\ndirect\n0.333333 0.666667 0.250000 Cr\n0.666667 0.333333 0.750000 Cr\n0.637984 0.024515 0.145706 O\n0.386531 0.362016 0.145706 O\n0.975485 0.613469 0.145706 O\n0.386531 0.024515 0.354294 O\n0.975485 0.362016 0.354294 O\n0.637984 0.613469 0.354294 O\n0.362016 0.386531 0.645706 O\n0.024515 0.637984 0.645706 O\n0.613469 0.975485 0.645706 O\n0.024515 0.386531 0.854294 O\n0.613469 0.637984 0.854294 O\n0.362016 0.975485 0.854294 O\n0.000000 0.000000 0.000000 Pr\n0.000000 0.000000 0.500000 Pr\n0.666667 0.333333 0.250000 Se\n0.333333 0.666667 0.750000 Se\n","nsites":18,"nelements":4,"elements":["Cr","O","Pr","Se"],"chemical_system":"Cr-O-Pr-Se","density":5.512056223125632,"density_atomic":0.08121276691087909,"volume":221.64002883626367,"volume_molar":7.415263620569105,"formula_full":"Pr2 Cr2 Se2 O12","formula_reduced":"PrCrSeO6","formula_anonymous":"ABCD6","formation_energy":-2.1795244113368657,"spacegroup":163},{"id":"oqmd-1736463","created_at":"2022-09-04T16:03:17.527201Z","updated_at":"2022-09-04T16:03:17.527229Z","structure_string":"Na1 Mn1 H6 O6 F1\n1.0\n2.861752 1.652233 4.305731\n-2.861752 1.652233 4.305731\n0.000000 -3.304467 4.305731\nF H Mn Na O\n1 6 1 1 6\ndirect\n0.535706 0.535706 0.535706 F\n0.990073 0.530230 0.005308 H\n0.795809 0.588724 0.317934 H\n0.005308 0.990073 0.530230 H\n0.317934 0.795809 0.588724 H\n0.588724 0.317934 0.795809 H\n0.530230 0.005308 0.990073 H\n0.017207 0.017207 0.017207 Mn\n0.361266 0.361266 0.361266 Na\n0.368040 0.839486 0.014321 O\n0.980880 0.610230 0.151896 O\n0.839486 0.014321 0.368040 O\n0.151896 0.980880 0.610230 O\n0.014321 0.368040 0.839486 O\n0.610230 0.151896 0.980880 O\n","nsites":15,"nelements":5,"elements":["F","H","Mn","Na","O"],"chemical_system":"F-H-Mn-Na-O","density":2.7048036293325444,"density_atomic":0.12279756077060244,"volume":122.15226349667833,"volume_molar":4.904120832864044,"formula_full":"Na1 Mn1 H6 O6 F1","formula_reduced":"NaMnH6O6F","formula_anonymous":"ABCD6E6","formation_energy":-1.2707648133714795,"spacegroup":146},{"id":"oqmd-1759375","created_at":"2022-09-04T16:03:17.523631Z","updated_at":"2022-09-04T16:03:17.523647Z","structure_string":"Tm4 Rh4 O12\n1.0\n5.719376 0.000000 0.000000\n0.000000 7.537115 0.000000\n0.000000 0.000000 5.197681\nO Rh Tm\n12 4 4\ndirect\n0.441809 0.250000 0.144776 O\n0.187251 0.565939 0.173235 O\n0.187251 0.934061 0.173235 O\n0.687251 0.565939 0.326765 O\n0.687251 0.934061 0.326765 O\n0.941809 0.250000 0.355224 O\n0.058191 0.750000 0.644776 O\n0.312749 0.065939 0.673235 O\n0.312749 0.434061 0.673235 O\n0.812749 0.065939 0.826765 O\n0.812749 0.434061 0.826765 O\n0.558191 0.750000 0.855224 O\n0.500000 0.000000 0.000000 Rh\n0.500000 0.500000 0.000000 Rh\n0.000000 0.000000 0.500000 Rh\n0.000000 0.500000 0.500000 Rh\n0.911880 0.750000 0.033650 Tm\n0.411880 0.750000 0.466350 Tm\n0.588120 0.250000 0.533650 Tm\n0.088120 0.250000 0.966350 Tm\n","nsites":20,"nelements":3,"elements":["O","Rh","Tm"],"chemical_system":"O-Rh-Tm","density":9.481468695812348,"density_atomic":0.08926199386033956,"volume":224.05952561727727,"volume_molar":6.746590009430348,"formula_full":"Tm4 Rh4 O12","formula_reduced":"TmRhO3","formula_anonymous":"ABC3","formation_energy":-2.450761337527253,"spacegroup":62},{"id":"oqmd-1753324","created_at":"2022-09-04T16:03:17.522608Z","updated_at":"2022-09-04T16:03:17.522631Z","structure_string":"Sr4 Ir3 O10\n1.0\n-1.969828 1.969828 14.231818\n1.969828 -1.969828 14.231818\n1.969828 1.969828 -14.231818\nIr O Sr\n3 10 4\ndirect\n0.000000 0.000000 0.000000 Ir\n0.143111 0.143111 0.000000 Ir\n0.856889 0.856889 0.000000 Ir\n0.070424 0.070424 0.000000 O\n0.213747 0.213747 0.000000 O\n0.786253 0.786253 0.000000 O\n0.929576 0.929576 0.000000 O\n0.500000 0.000000 0.500000 O\n0.638555 0.138555 0.500000 O\n0.861445 0.361445 0.500000 O\n0.000000 0.500000 0.500000 O\n0.138555 0.638555 0.500000 O\n0.361445 0.861445 0.500000 O\n0.297350 0.297350 0.000000 Sr\n0.430091 0.430091 0.000000 Sr\n0.569909 0.569909 0.000000 Sr\n0.702650 0.702650 0.000000 Sr\n","nsites":17,"nelements":3,"elements":["Ir","O","Sr"],"chemical_system":"Ir-O-Sr","density":8.172437259599114,"density_atomic":0.07696121865396348,"volume":220.89047311524746,"volume_molar":7.824903068488329,"formula_full":"Sr4 Ir3 O10","formula_reduced":"Sr4Ir3O10","formula_anonymous":"A3B4C10","formation_energy":-1.9115512787522084,"spacegroup":139}]}