{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=4386","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=formula_anonymous&page=4384","results":[{"id":"jvasp-104153","created_at":"2022-09-04T14:36:50.964129Z","updated_at":"2022-09-04T14:36:50.964157Z","structure_string":"H8 C8 S2 O2\n1.0\n5.104123 0.037714 -0.065639\n-0.611062 6.129087 -1.835010\n0.141011 -0.028691 6.555091\nH C S O\n8 8 2 2\ndirect\n0.326593 0.171742 0.985468 H\n0.609886 0.309653 0.427053 H\n0.566079 0.043169 0.264653 H\n0.378506 0.439102 0.146365 H\n0.326599 0.671730 0.485439 H\n0.609900 0.809713 0.927023 H\n0.566070 0.543208 0.764679 H\n0.378492 0.939099 0.646319 H\n0.846519 0.240832 0.148967 C\n0.846516 0.740809 0.648929 C\n0.351776 0.768251 0.653622 C\n0.590985 0.714212 0.758778 C\n0.590984 0.214189 0.258796 C\n0.351777 0.268250 0.153654 C\n0.101388 0.245137 0.270608 C\n0.101387 0.745139 0.770576 C\n0.087977 0.228096 0.514508 S\n0.087975 0.728105 0.014478 S\n0.856044 0.750860 0.464086 O\n0.856052 0.250949 0.964148 O\n","nsites":20,"nelements":4,"elements":["H","C","S","O"],"chemical_system":"C-H-O-S","density":1.6223281042691289,"density_atomic":0.09756330808896875,"volume":204.9950989952272,"volume_molar":6.172546706296964,"formula_full":"H8 C8 S2 O2","formula_reduced":"H4C4SO","formula_anonymous":"ABC4D4","energy_above_hull":4.62921635,"spacegroup":1},{"id":"jvasp-29452","created_at":"2022-09-04T14:37:02.879129Z","updated_at":"2022-09-04T14:37:02.879153Z","structure_string":"Cu4 S16 Br4 N16\n1.0\n6.921146 -0.019023 0.000000\n-2.490589 8.800026 0.000000\n0.000000 0.000000 11.751153\nCu S Br N\n4 16 4 16\ndirect\n0.136738 0.421791 0.168116 Cu\n0.863263 0.578209 0.831884 Cu\n0.363262 0.578209 0.668116 Cu\n0.636738 0.421792 0.331884 Cu\n0.974790 0.698051 0.082212 S\n0.889094 0.767120 0.386516 S\n0.304306 0.004570 0.620825 S\n0.260650 0.144311 0.416448 S\n0.195694 0.995431 0.120825 S\n0.025211 0.301950 0.917788 S\n0.474789 0.698051 0.417788 S\n0.804306 0.004570 0.879174 S\n0.610907 0.232881 0.886516 S\n0.695695 0.995431 0.379175 S\n0.110907 0.232881 0.613483 S\n0.525211 0.301950 0.582212 S\n0.739351 0.855690 0.583551 S\n0.389093 0.767120 0.113483 S\n0.760651 0.144311 0.083551 S\n0.239350 0.855690 0.916448 S\n0.975688 0.389541 0.352966 Br\n0.475688 0.389541 0.147034 Br\n0.024313 0.610460 0.647034 Br\n0.524313 0.610460 0.852966 Br\n0.367421 0.922432 0.171553 N\n0.132580 0.077568 0.671553 N\n0.230537 0.008163 0.983734 N\n0.025491 0.727914 0.945181 N\n0.166265 0.642867 0.130624 N\n0.974510 0.272087 0.054819 N\n0.666266 0.642867 0.369376 N\n0.269464 0.991838 0.483734 N\n0.867421 0.922433 0.328446 N\n0.333735 0.357133 0.630624 N\n0.730537 0.008163 0.516266 N\n0.525491 0.727914 0.554819 N\n0.769464 0.991838 0.016266 N\n0.474509 0.272087 0.445181 N\n0.833735 0.357134 0.869376 N\n0.632580 0.077568 0.828446 N\n","nsites":40,"nelements":4,"elements":["Cu","S","Br","N"],"chemical_system":"Br-Cu-N-S","density":3.043896046030329,"density_atomic":0.05593137680705007,"volume":715.1620840300512,"volume_molar":10.767016840609791,"formula_full":"Cu4 S16 Br4 N16","formula_reduced":"CuS4BrN4","formula_anonymous":"ABC4D4","energy_above_hull":3.3513537555,"spacegroup":14},{"id":"jvasp-109724","created_at":"2022-09-04T14:37:56.073520Z","updated_at":"2022-09-04T14:37:56.073541Z","structure_string":"La1 Pr1 Mn4 Si4\n1.0\n3.997506 0.000000 0.000000\n0.000000 3.997506 0.000000\n-0.000000 0.000000 10.580778\nLa Pr Mn Si\n1 1 4 4\ndirect\n0.000000 0.000000 0.000000 La\n0.500000 0.500000 0.500000 Pr\n-0.000000 0.500000 0.252038 Mn\n0.500000 0.000000 0.747962 Mn\n0.500000 0.000000 0.252038 Mn\n-0.000000 0.500000 0.747962 Mn\n0.500000 0.500000 0.131360 Si\n0.000000 0.000000 0.626848 Si\n0.000000 0.000000 0.373152 Si\n0.500000 0.500000 0.868641 Si\n","nsites":10,"nelements":4,"elements":["La","Pr","Mn","Si"],"chemical_system":"La-Mn-Pr-Si","density":6.009507491353037,"density_atomic":0.05914310880701863,"volume":169.08140613016405,"volume_molar":10.182320276145749,"formula_full":"La1 Pr1 Mn4 Si4","formula_reduced":"LaPr(MnSi)4","formula_anonymous":"ABC4D4","energy_above_hull":3.909651821551724,"spacegroup":123},{"id":"jvasp-25601","created_at":"2022-09-04T14:37:40.573746Z","updated_at":"2022-09-04T14:37:40.573756Z","structure_string":"K2 Cu8 As2 S8\n1.0\n0.000000 6.541521 -0.029325\n6.432837 0.000000 0.000000\n0.000000 -2.137219 -9.376326\nK Cu As S\n2 8 2 8\ndirect\n0.675795 0.028965 0.137966 K\n0.324205 0.528966 0.862035 K\n0.922561 0.909209 0.877228 Cu\n0.367931 0.032150 0.614071 Cu\n0.632069 0.532150 0.385930 Cu\n0.077439 0.409209 0.122773 Cu\n0.020850 0.665602 0.487467 Cu\n0.293947 0.381527 0.455690 Cu\n0.979150 0.165602 0.512534 Cu\n0.706053 0.881528 0.544310 Cu\n0.802755 0.384297 0.749861 As\n0.197245 0.884297 0.250140 As\n0.390233 0.620359 0.187246 S\n0.939574 0.399593 0.339840 S\n0.836595 0.587706 0.951328 S\n0.060426 0.899594 0.660161 S\n0.609767 0.120359 0.812755 S\n0.163405 0.087706 0.048673 S\n0.537876 0.582692 0.602689 S\n0.462124 0.082692 0.397312 S\n","nsites":20,"nelements":4,"elements":["K","Cu","As","S"],"chemical_system":"As-Cu-K-S","density":4.17454586179068,"density_atomic":0.05063752429424723,"volume":394.96401687773937,"volume_molar":11.892644523863812,"formula_full":"K2 Cu8 As2 S8","formula_reduced":"KCu4AsS4","formula_anonymous":"ABC4D4","energy_above_hull":0.8279631550000001,"spacegroup":4},{"id":"jvasp-32189","created_at":"2022-09-04T14:38:04.041757Z","updated_at":"2022-09-04T14:38:04.041780Z","structure_string":"Re2 H8 N2 O8\n1.0\n5.553421 0.000000 -2.410913\n-1.046653 5.453898 -2.410913\n-0.047029 -0.056912 7.493144\nRe H N O\n2 8 2 8\ndirect\n0.000000 0.000000 0.000000 Re\n0.250000 0.750001 0.500000 Re\n0.848193 0.169871 0.599592 H\n0.401807 0.580130 0.900409 H\n0.419871 0.501399 0.099592 H\n0.570280 0.151807 0.400409 H\n0.751399 0.429720 0.599592 H\n0.679720 0.598193 0.099592 H\n0.498602 0.320281 0.900409 H\n0.830129 0.248602 0.400409 H\n0.500000 0.500000 0.000001 N\n0.750000 0.250000 0.500000 N\n0.457987 0.033634 0.663113 O\n0.283635 0.955126 0.163114 O\n0.792013 0.716367 0.836887 O\n0.370521 0.542013 0.336887 O\n0.966366 0.794875 0.336888 O\n0.205126 0.629480 0.663114 O\n0.879479 0.207988 0.163114 O\n0.044874 0.120521 0.836887 O\n","nsites":20,"nelements":4,"elements":["Re","H","N","O"],"chemical_system":"H-N-O-Re","density":3.9518642782635443,"density_atomic":0.08872059152748701,"volume":225.42681079627033,"volume_molar":6.787759928465139,"formula_full":"Re2 H8 N2 O8","formula_reduced":"ReH4NO4","formula_anonymous":"ABC4D4","energy_above_hull":3.724685525000001,"spacegroup":88},{"id":"jvasp-33501","created_at":"2022-09-04T14:38:03.362926Z","updated_at":"2022-09-04T14:38:03.362936Z","structure_string":"B4 H16 N4 F16\n1.0\n7.029684 0.000000 0.000000\n0.000000 8.371927 0.000000\n-0.000000 0.000000 5.988424\nB H N F\n4 16 4 16\ndirect\n0.808433 0.585371 0.250000 B\n0.691566 0.085371 0.250000 B\n0.191566 0.414629 0.750000 B\n0.308433 0.914629 0.750000 B\n0.344268 0.609775 0.390147 H\n0.844268 0.890225 0.609853 H\n0.655732 0.390225 0.890146 H\n0.844268 0.890225 0.890146 H\n0.655732 0.390225 0.609853 H\n0.155732 0.109775 0.390147 H\n0.344268 0.609775 0.109853 H\n0.155732 0.109775 0.109853 H\n0.822239 0.285180 0.750000 H\n0.322239 0.214821 0.250000 H\n0.177760 0.714821 0.250000 H\n0.906450 0.722550 0.750000 H\n0.593550 0.222550 0.750000 H\n0.093550 0.277451 0.250000 H\n0.406450 0.777451 0.250000 H\n0.677760 0.785180 0.750000 H\n0.818633 0.821334 0.750000 N\n0.681366 0.321334 0.750000 N\n0.181367 0.178667 0.250000 N\n0.318633 0.678667 0.250000 N\n0.308806 0.419455 0.942537 F\n0.191193 0.919455 0.557462 F\n0.191193 0.919455 0.942537 F\n0.308806 0.419455 0.557462 F\n0.808806 0.080545 0.442538 F\n0.691193 0.580545 0.057462 F\n0.413996 0.770054 0.750000 F\n0.565340 0.954124 0.250000 F\n0.586003 0.229946 0.250000 F\n0.913996 0.729946 0.250000 F\n0.434660 0.045876 0.750000 F\n0.065340 0.545876 0.750000 F\n0.934659 0.454124 0.250000 F\n0.691193 0.580545 0.442538 F\n0.086003 0.270054 0.750000 F\n0.808806 0.080545 0.057462 F\n","nsites":40,"nelements":4,"elements":["B","H","N","F"],"chemical_system":"B-F-H-N","density":1.975945909468334,"density_atomic":0.11349747853896086,"volume":352.4307369195783,"volume_molar":5.305968764700573,"formula_full":"B4 H16 N4 F16","formula_reduced":"BH4NF4","formula_anonymous":"ABC4D4","energy_above_hull":2.136453696333333,"spacegroup":62},{"id":"jvasp-111359","created_at":"2022-09-04T14:38:48.242405Z","updated_at":"2022-09-04T14:38:48.242430Z","structure_string":"La1 Pr1 Co4 P4\n1.0\n3.787508 0.000000 0.000000\n0.000000 3.787508 0.000000\n-0.000000 -0.000000 11.083870\nLa Pr Co P\n1 1 4 4\ndirect\n0.500000 0.500000 0.500000 La\n0.000000 0.000000 0.000000 Pr\n0.500000 0.000000 0.246821 Co\n-0.000000 0.500000 0.753179 Co\n-0.000000 0.500000 0.246821 Co\n0.500000 0.000000 0.753179 Co\n0.500000 0.500000 0.141825 P\n0.000000 0.000000 0.648565 P\n0.000000 0.000000 0.351435 P\n0.500000 0.500000 0.858175 P\n","nsites":10,"nelements":4,"elements":["La","Pr","Co","P"],"chemical_system":"Co-La-P-Pr","density":6.678070510083297,"density_atomic":0.06289287659260837,"volume":159.00051868791883,"volume_molar":9.575235044516578,"formula_full":"La1 Pr1 Co4 P4","formula_reduced":"LaPr(CoP)4","formula_anonymous":"ABC4D4","energy_above_hull":3.328677045,"spacegroup":123},{"id":"jvasp-113021","created_at":"2022-09-04T14:38:46.219355Z","updated_at":"2022-09-04T14:38:46.219373Z","structure_string":"La2 N2 Cl8 O8\n1.0\n4.067722 -0.000000 0.000000\n0.000000 8.350717 0.000000\n-0.000000 -0.000000 12.542760\nLa N Cl O\n2 2 8 8\ndirect\n0.511064 0.000000 0.500000 La\n0.488936 0.500000 -0.000000 La\n-0.048238 0.000000 0.000000 N\n0.048238 0.500000 0.500000 N\n0.794634 0.614537 0.209760 Cl\n0.794634 0.385463 0.790240 Cl\n0.205365 0.114537 0.290240 Cl\n0.205365 0.885463 0.709760 Cl\n0.456639 0.307146 0.596694 Cl\n0.543361 0.807146 0.903306 Cl\n0.543361 0.192854 0.096694 Cl\n0.456639 0.692854 0.403306 Cl\n0.037112 0.079362 0.927848 O\n-0.005920 0.568288 0.094028 O\n-0.005920 0.431713 0.905972 O\n0.005920 0.931713 0.594028 O\n0.005920 0.068287 0.405972 O\n0.962888 0.420638 0.427848 O\n0.962888 0.579363 0.572152 O\n0.037112 0.920638 0.072152 O\n","nsites":20,"nelements":4,"elements":["La","N","Cl","O"],"chemical_system":"Cl-La-N-O","density":2.7962029162036237,"density_atomic":0.04694202852734572,"volume":426.0574292896003,"volume_molar":12.828889055128599,"formula_full":"La2 N2 Cl8 O8","formula_reduced":"LaN(ClO)4","formula_anonymous":"ABC4D4","energy_above_hull":1.954087852,"spacegroup":18},{"id":"jvasp-100834","created_at":"2022-09-04T14:36:36.768583Z","updated_at":"2022-09-04T14:36:36.768592Z","structure_string":"Hf1 Nb4 C1 N4\n1.0\n3.158157 0.019053 -11.053115\n-0.043639 3.157913 -11.053115\n-0.018678 -0.019053 11.495432\nHf Nb C N\n1 4 1 4\ndirect\n0.000000 0.000000 0.000000 Hf\n0.404113 0.404112 -0.000000 Nb\n0.794908 0.794906 -0.000000 Nb\n0.205092 0.205092 -0.000000 Nb\n0.595887 0.595886 -0.000000 Nb\n0.500000 0.499999 -0.000000 C\n0.897971 0.897968 -0.000000 N\n0.303839 0.303838 -0.000000 N\n0.696162 0.696160 -0.000000 N\n0.102030 0.102030 -0.000000 N\n","nsites":10,"nelements":4,"elements":["Hf","Nb","C","N"],"chemical_system":"C-Hf-N-Nb","density":9.057064273474397,"density_atomic":0.08823529802714353,"volume":113.33332831180253,"volume_molar":6.825092558929681,"formula_full":"Hf1 Nb4 C1 N4","formula_reduced":"HfNb4CN4","formula_anonymous":"ABC4D4","energy_above_hull":6.37494636,"spacegroup":139},{"id":"jvasp-87845","created_at":"2022-09-04T14:36:18.849846Z","updated_at":"2022-09-04T14:36:18.849873Z","structure_string":"K2 Tl2 C8 N8\n1.0\n6.788369 0.000014 -3.053161\n-1.373208 6.648033 -3.053149\n-0.033801 -0.041514 8.998025\nK Tl C N\n2 2 8 8\ndirect\n0.375000 0.125000 0.750000 K\n0.625000 0.874999 0.250000 K\n0.125000 0.375000 0.250000 Tl\n0.875000 0.625000 0.749999 Tl\n0.945782 0.352124 0.578015 C\n0.852124 0.132233 0.078016 C\n0.147876 0.867767 0.921984 C\n0.632233 0.725890 0.578015 C\n0.774109 0.554217 0.921984 C\n0.367767 0.274109 0.421984 C\n0.054218 0.647876 0.421984 C\n0.225891 0.445782 0.078016 C\n0.719758 0.514526 0.011185 N\n0.014527 0.791426 0.511185 N\n0.291426 0.996657 0.011185 N\n0.503343 0.780241 0.488814 N\n0.280242 0.485473 0.988814 N\n0.708574 0.003343 0.988814 N\n0.985473 0.208573 0.488814 N\n0.496657 0.219758 0.511185 N\n","nsites":20,"nelements":4,"elements":["K","Tl","C","N"],"chemical_system":"C-K-N-Tl","density":2.854538573979587,"density_atomic":0.0494615846623329,"volume":404.3542101721389,"volume_molar":12.17538985277622,"formula_full":"K2 Tl2 C8 N8","formula_reduced":"KTl(CN)4","formula_anonymous":"ABC4D4","energy_above_hull":5.20642136,"spacegroup":88},{"id":"jvasp-108745","created_at":"2022-09-04T14:38:17.767007Z","updated_at":"2022-09-04T14:38:17.767016Z","structure_string":"Nd1 Sm1 Mn4 Ge4\n1.0\n3.985557 -0.000000 0.000000\n0.000000 3.985557 0.000000\n-0.000000 -0.000000 10.912024\nNd Sm Mn Ge\n1 1 4 4\ndirect\n0.000000 0.000000 0.000000 Nd\n0.500000 0.500000 0.500000 Sm\n-0.000000 0.500000 0.251800 Mn\n0.500000 0.000000 0.748200 Mn\n0.500000 0.000000 0.251800 Mn\n-0.000000 0.500000 0.748200 Mn\n0.500000 0.500000 0.125101 Ge\n0.000000 0.000000 0.621880 Ge\n0.000000 0.000000 0.378120 Ge\n0.500000 0.500000 0.874899 Ge\n","nsites":10,"nelements":4,"elements":["Nd","Sm","Mn","Ge"],"chemical_system":"Ge-Mn-Nd-Sm","density":7.711081868037803,"density_atomic":0.05769213860445979,"volume":173.3338413498675,"volume_molar":10.438407910804106,"formula_full":"Nd1 Sm1 Mn4 Ge4","formula_reduced":"NdSm(MnGe)4","formula_anonymous":"ABC4D4","energy_above_hull":2.748125314051724,"spacegroup":123},{"id":"jvasp-55702","created_at":"2022-09-04T14:38:09.751988Z","updated_at":"2022-09-04T14:38:09.752008Z","structure_string":"Tc2 H8 N2 O8\n1.0\n5.577592 -0.000004 -2.228232\n-0.890169 5.506098 -2.228236\n-0.244490 -0.287187 7.482889\nTc H N O\n2 8 2 8\ndirect\n0.125000 0.375000 0.250000 Tc\n0.875000 0.625000 0.750000 Tc\n0.279558 0.207365 0.650712 H\n0.720442 0.792635 0.349288 H\n0.707365 0.871155 0.150712 H\n0.556652 0.220442 0.849288 H\n0.371154 0.943347 0.650712 H\n0.443347 0.779558 0.150712 H\n0.628845 0.056653 0.349288 H\n0.292635 0.128845 0.849288 H\n0.625000 0.875001 0.250000 N\n0.375000 0.125000 0.750000 N\n0.843150 0.416787 0.090272 O\n0.916786 0.747123 0.590272 O\n0.156850 0.583214 0.909727 O\n0.326514 0.656850 0.409728 O\n0.083214 0.252878 0.409728 O\n0.247122 0.173486 0.090272 O\n0.673486 0.343150 0.590272 O\n0.752877 0.826514 0.909728 O\n","nsites":20,"nelements":4,"elements":["Tc","H","N","O"],"chemical_system":"H-N-O-Tc","density":2.6852404138238284,"density_atomic":0.08982031573050454,"volume":222.66677463044869,"volume_molar":6.704653296998795,"formula_full":"Tc2 H8 N2 O8","formula_reduced":"TcH4NO4","formula_anonymous":"ABC4D4","energy_above_hull":3.5529628750000004,"spacegroup":88}]}