{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3455","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=3453","results":[{"id":"jvasp-113070","created_at":"2022-09-04T14:38:46.519732Z","updated_at":"2022-09-04T14:38:46.519756Z","structure_string":"Nd4 Si4 Pb2 S16\n1.0\n8.121968 -0.060235 3.734761\n3.091138 7.510983 3.734761\n-0.041470 -0.027556 10.165764\nNd Si Pb S\n4 4 2 16\ndirect\n0.060640 0.254122 0.750497 Nd\n0.441588 0.560706 0.754803 Nd\n0.254123 0.060639 0.250497 Nd\n0.560707 0.441587 0.254803 Nd\n0.646231 0.176557 0.020238 Si\n0.176558 0.646230 0.520238 Si\n0.325961 0.851345 0.980433 Si\n0.851347 0.325959 0.480433 Si\n0.913103 0.753797 0.241043 Pb\n0.753799 0.913101 0.741043 Pb\n0.099098 0.569414 0.761360 S\n0.569415 0.099097 0.261360 S\n0.796007 0.532704 0.569561 S\n0.072541 0.103305 0.548663 S\n0.615220 0.272677 0.566492 S\n0.532705 0.796005 0.069561 S\n0.272678 0.615219 0.066492 S\n0.423625 0.236281 0.952756 S\n0.236282 0.423624 0.452756 S\n0.983689 0.877448 0.420220 S\n0.408450 0.709326 0.444205 S\n0.397241 0.918920 0.739726 S\n0.709328 0.408449 0.944205 S\n0.877451 0.983687 0.920220 S\n0.103306 0.072541 0.048664 S\n0.918922 0.397239 0.239726 S\n","nsites":26,"nelements":4,"elements":["Nd","Si","Pb","S"],"chemical_system":"Nd-Pb-S-Si","density":4.304193520679364,"density_atomic":0.04168436310301439,"volume":623.7350906800785,"volume_molar":14.447001973179987,"formula_full":"Nd4 Si4 Pb2 S16","formula_reduced":"Nd2Si2PbS8","formula_anonymous":"AB2C2D8","energy_above_hull":2.254485463076923,"spacegroup":9},{"id":"jvasp-113210","created_at":"2022-09-04T14:38:47.901357Z","updated_at":"2022-09-04T14:38:47.901390Z","structure_string":"Li1 Mn2 P2 O8\n1.0\n4.887867 -0.039003 0.124586\n-0.237601 4.882242 -0.124603\n0.042998 -0.041261 7.080957\nLi Mn P O\n1 2 2 8\ndirect\n0.493742 0.493741 0.000001 Li\n0.961384 0.961381 -0.000001 Mn\n0.549840 0.549842 0.500003 Mn\n0.479833 0.016245 0.250475 P\n0.016245 0.479832 0.749526 P\n0.562695 0.710760 0.239378 O\n0.638524 0.152633 0.076566 O\n0.147219 0.570644 0.561375 O\n0.171691 0.044797 0.222553 O\n0.044795 0.171687 0.777447 O\n0.570641 0.147219 0.438625 O\n0.152636 0.638523 0.923436 O\n0.710758 0.562697 0.760626 O\n","nsites":13,"nelements":4,"elements":["Li","Mn","P","O"],"chemical_system":"Li-Mn-O-P","density":3.016572767896254,"density_atomic":0.07698561707802927,"volume":168.86271089863143,"volume_molar":7.8224231857441895,"formula_full":"Li1 Mn2 P2 O8","formula_reduced":"LiMn2(PO4)2","formula_anonymous":"AB2C2D8","energy_above_hull":3.0910394986737404,"spacegroup":5},{"id":"jvasp-57442","created_at":"2022-09-04T14:37:31.532243Z","updated_at":"2022-09-04T14:37:31.532259Z","structure_string":"Nd4 Cu2 Ge4 O16\n1.0\n5.199462 0.013888 -0.000125\n-0.122966 8.442519 -0.000252\n-2.538125 -4.227915 7.746059\nNd Cu Ge O\n4 2 4 16\ndirect\n0.348949 0.638482 0.758468 Nd\n0.580697 0.377074 0.240087 Nd\n0.340626 0.136988 0.759917 Nd\n0.590475 0.880014 0.241532 Nd\n0.771108 0.760866 0.586692 Cu\n0.184400 0.174165 0.413301 Cu\n0.772186 0.305839 0.578872 Ge\n0.922280 0.504000 0.000004 Ge\n0.004793 0.000819 -0.000003 Ge\n0.193315 0.726970 0.421132 Ge\n0.223103 0.838042 -0.000003 O\n0.891375 0.089876 0.187451 O\n0.825086 0.677385 0.343456 O\n0.386038 0.929842 0.466568 O\n0.229163 0.595885 0.184934 O\n0.147530 0.837358 0.651772 O\n0.481631 0.333930 0.656546 O\n0.716149 0.669973 0.000002 O\n0.044229 0.410953 0.815070 O\n0.495751 0.185588 0.348230 O\n0.213793 0.170932 0.000000 O\n0.919473 0.463272 0.533433 O\n0.716639 0.333971 0.000004 O\n0.938673 0.108614 0.517266 O\n0.703926 0.902429 0.812542 O\n0.421413 0.591353 0.482739 O\n","nsites":26,"nelements":4,"elements":["Nd","Cu","Ge","O"],"chemical_system":"Cu-Ge-Nd-O","density":6.107360418570125,"density_atomic":0.07646378018767408,"volume":340.03027232220444,"volume_molar":7.875808317636335,"formula_full":"Nd4 Cu2 Ge4 O16","formula_reduced":"Nd2Cu(GeO4)2","formula_anonymous":"AB2C2D8","energy_above_hull":2.0581056423076927,"spacegroup":8},{"id":"jvasp-49589","created_at":"2022-09-04T14:37:18.155163Z","updated_at":"2022-09-04T14:37:18.155184Z","structure_string":"Mg4 Nb4 Fe2 O16\n1.0\n-5.172585 -0.000024 0.000114\n-0.000188 -5.990417 -0.000909\n0.157467 2.993312 9.520347\nMg Nb Fe O\n4 4 2 16\ndirect\n0.754541 0.588227 0.459041 Mg\n0.748534 0.129944 0.542429 Mg\n0.248544 0.411444 0.542454 Mg\n0.254550 0.869726 0.459061 Mg\n0.749409 0.716730 0.770697 Nb\n0.753671 0.946758 0.230785 Nb\n0.253656 0.282929 0.230795 Nb\n0.249390 0.052899 0.770700 Nb\n0.251531 0.642238 0.000749 Fe\n0.751525 0.357409 0.000739 Fe\n0.888998 0.452819 0.619135 O\n0.614083 0.834426 0.382352 O\n0.114075 0.546853 0.382354 O\n0.388996 0.165241 0.619138 O\n0.045184 0.084278 0.375644 O\n0.457889 0.709389 0.625834 O\n0.086166 0.319393 0.883939 O\n0.911201 0.183863 0.138519 O\n0.916882 0.680264 0.117542 O\n0.586176 0.563474 0.883940 O\n0.591852 0.046077 0.862968 O\n0.957889 0.915384 0.625840 O\n0.411209 0.953569 0.138524 O\n0.091858 0.815794 0.862970 O\n0.416874 0.436161 0.117540 O\n0.545186 0.290276 0.375655 O\n","nsites":26,"nelements":4,"elements":["Mg","Nb","Fe","O"],"chemical_system":"Fe-Mg-Nb-O","density":4.70903147065381,"density_atomic":0.08814068900614883,"volume":294.9829448030092,"volume_molar":6.832418520780893,"formula_full":"Mg4 Nb4 Fe2 O16","formula_reduced":"Mg2Nb2FeO8","formula_anonymous":"AB2C2D8","energy_above_hull":2.8258392615384613,"spacegroup":15},{"id":"jvasp-21430","created_at":"2022-09-04T14:37:30.892977Z","updated_at":"2022-09-04T14:37:30.892998Z","structure_string":"Ca4 Be8 P8 O32\n1.0\n0.000000 7.845017 0.002359\n8.839444 0.000000 0.000000\n0.000000 -0.068576 -8.319258\nCa Be P O\n4 8 8 32\ndirect\n0.243722 0.586278 0.884149 Ca\n0.756277 0.086278 0.615851 Ca\n0.756278 0.413722 0.115851 Ca\n0.243722 0.913722 0.384149 Ca\n0.570364 0.804584 0.053934 Be\n0.069937 0.922831 0.765016 Be\n0.930063 0.422831 0.734984 Be\n0.930063 0.077169 0.234984 Be\n0.069937 0.577168 0.265016 Be\n0.429636 0.304585 0.446066 Be\n0.429636 0.195415 0.946066 Be\n0.570364 0.695415 0.553934 Be\n0.439005 0.581127 0.260658 P\n0.560995 0.081127 0.239342 P\n0.439004 0.918872 0.760659 P\n0.560995 0.418872 0.739342 P\n0.061380 0.301950 0.443057 P\n0.061379 0.198050 0.943057 P\n0.938620 0.698050 0.556943 P\n0.938621 0.801949 0.056943 P\n0.997248 0.410573 0.308326 O\n0.997248 0.089427 0.808326 O\n0.002752 0.589427 0.691674 O\n0.563654 0.631833 0.126954 O\n0.436346 0.131833 0.373046 O\n0.436346 0.368167 0.873046 O\n0.942463 0.636000 0.120288 O\n0.057537 0.136000 0.379712 O\n0.057537 0.364000 0.879713 O\n0.942463 0.864000 0.620288 O\n0.434347 0.692576 0.402634 O\n0.565653 0.192576 0.097366 O\n0.002752 0.910573 0.191674 O\n0.563654 0.868166 0.626955 O\n0.495207 0.575523 0.687936 O\n0.239503 0.154490 0.001180 O\n0.504793 0.424477 0.312065 O\n0.495207 0.924477 0.187935 O\n0.069041 0.690414 0.418427 O\n0.930959 0.190414 0.081573 O\n0.930959 0.309586 0.581574 O\n0.069040 0.809585 0.918427 O\n0.760497 0.845510 -0.001181 O\n0.239503 0.345510 0.501181 O\n0.565653 0.307424 0.597366 O\n0.760497 0.654490 0.498820 O\n0.741239 0.422604 0.818681 O\n0.741239 0.077396 0.318681 O\n0.258761 0.577396 0.181319 O\n0.258761 0.922604 0.681319 O\n0.504793 0.075523 0.812065 O\n0.434347 0.807424 0.902634 O\n","nsites":52,"nelements":4,"elements":["Ca","Be","P","O"],"chemical_system":"Be-Ca-O-P","density":2.855862972167737,"density_atomic":0.09013656202815966,"volume":576.9024115181431,"volume_molar":6.6811298595109685,"formula_full":"Ca4 Be8 P8 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O\n0.606094 0.912677 0.114092 O\n0.933087 0.080202 0.368799 O\n0.390691 0.091143 0.886987 O\n0.062274 0.203510 0.135353 O\n0.409200 0.550744 0.886430 O\n0.571948 0.703298 0.618680 O\n","nsites":26,"nelements":4,"elements":["Mg","Ta","Nb","O"],"chemical_system":"Mg-Nb-O-Ta","density":6.001325726174309,"density_atomic":0.08646674727796015,"volume":300.6936286896413,"volume_molar":6.9646898369392085,"formula_full":"Mg4 Ta2 Nb4 O16","formula_reduced":"Mg2TaNb2O8","formula_anonymous":"AB2C2D8","energy_above_hull":3.1205057,"spacegroup":2},{"id":"jvasp-19166","created_at":"2022-09-04T14:38:36.581548Z","updated_at":"2022-09-04T14:38:36.581577Z","structure_string":"Mg4 Ta4 Sn2 O16\n1.0\n-5.293614 0.001119 0.011148\n-0.000528 -6.029496 -0.001957\n0.328042 3.015201 10.409364\nMg Ta Sn O\n4 4 2 16\ndirect\n0.243480 0.870220 0.459740 Mg\n0.255517 0.410617 0.540244 Mg\n0.755563 0.128940 0.540204 Mg\n0.743519 0.588532 0.459697 Mg\n0.269018 0.042271 0.745441 Ta\n0.230009 0.296260 0.254564 Ta\n0.730030 0.956865 0.254503 Ta\n0.769045 0.702872 0.745382 Ta\n0.749517 0.305905 0.000525 Sn\n0.249543 0.693192 0.999411 Sn\n0.119803 0.157330 0.607010 O\n0.379257 0.550121 0.392948 O\n0.879237 0.841823 0.392941 O\n0.619783 0.449038 0.606989 O\n0.947291 0.301449 0.383170 O\n0.551835 0.918618 0.616898 O\n0.884498 0.547025 0.860215 O\n0.037280 0.999112 0.168334 O\n0.114549 0.452064 0.139710 O\n0.384167 0.313230 0.860286 O\n0.461561 0.831092 0.831609 O\n0.051768 0.697710 0.616780 O\n0.537513 0.168060 0.168343 O\n0.961793 0.000009 0.831627 O\n0.614872 0.685912 0.139659 O\n0.447210 0.080540 0.383048 O\n","nsites":26,"nelements":4,"elements":["Mg","Ta","Sn","O"],"chemical_system":"Mg-O-Sn-Ta","density":6.569592587586527,"density_atomic":0.07825784692568435,"volume":332.2350540092198,"volume_molar":7.695254848652785,"formula_full":"Mg4 Ta4 Sn2 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0.491497 O\n0.495898 0.991795 0.209705 O\n0.008204 0.504102 0.209705 O\n0.495898 0.504102 0.209705 O\n0.504103 0.008204 0.790296 O\n0.991797 0.495897 0.790296 O\n0.504103 0.495897 0.790296 O\n","nsites":13,"nelements":4,"elements":["Ba","Be","P","O"],"chemical_system":"Ba-Be-O-P","density":3.4237114018259733,"density_atomic":0.0776251158626832,"volume":167.47156967851308,"volume_molar":7.757979737708875,"formula_full":"Ba1 Be2 P2 O8","formula_reduced":"BaBe2(PO4)2","formula_anonymous":"AB2C2D8","energy_above_hull":2.4896043976923075,"spacegroup":164},{"id":"jvasp-112709","created_at":"2022-09-04T14:38:42.492501Z","updated_at":"2022-09-04T14:38:42.492519Z","structure_string":"Ba2 Sr1 P2 O8\n1.0\n5.182405 -0.006301 5.635484\n2.193079 4.695504 5.635484\n-0.009911 -0.006301 7.656102\nBa Sr P O\n2 1 2 8\ndirect\n0.206747 0.206747 0.206747 Ba\n0.793252 0.793252 0.793252 Ba\n0.000000 0.000000 0.000000 Sr\n0.403578 0.403578 0.403578 P\n0.596421 0.596421 0.596421 P\n0.276295 0.734287 0.276294 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Zn\n0.719113 0.869962 0.438938 Zn\n0.219152 0.569310 0.438948 Zn\n0.278542 0.130432 0.561048 Zn\n0.248817 0.311184 0.000143 Sn\n0.748833 0.689165 -0.000149 Sn\n0.850143 0.547640 0.397887 O\n0.647528 0.149804 0.602095 O\n0.147519 0.452752 0.602095 O\n0.350130 0.850600 0.397897 O\n0.085418 0.931243 0.637942 O\n0.412275 0.293197 0.362084 O\n0.112611 0.682899 0.139163 O\n0.981813 0.833838 0.839261 O\n0.885051 0.317457 0.860835 O\n0.612526 0.456383 0.139146 O\n0.515755 0.994492 0.160701 O\n0.912240 0.069156 0.362047 O\n0.481908 0.005874 0.839291 O\n0.015835 0.166506 0.160713 O\n0.385144 0.543977 0.860835 O\n0.585374 0.707197 0.637891 O\n","nsites":26,"nelements":4,"elements":["Ta","Zn","Sn","O"],"chemical_system":"O-Sn-Ta-Zn","density":7.2845179324729346,"density_atomic":0.07712665372447713,"volume":337.10784462244294,"volume_molar":7.808118813909848,"formula_full":"Ta4 Zn4 Sn2 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0.799403 0.002052 O\n0.973874 0.076583 0.207927 O\n0.487665 0.911682 0.294920 O\n0.473854 0.920036 0.707929 O\n0.026125 0.576583 0.792073 O\n0.987676 0.084957 0.794917 O\n","nsites":26,"nelements":4,"elements":["Li","V","P","O"],"chemical_system":"Li-O-P-V","density":3.520260823809056,"density_atomic":0.09224373347643336,"volume":281.8619652536347,"volume_molar":6.528509344798527,"formula_full":"Li2 V4 P4 O16","formula_reduced":"LiV2(PO4)2","formula_anonymous":"AB2C2D8","energy_above_hull":3.0942667230769234,"spacegroup":14}]}