{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=490","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-nelements&page=488","results":[{"id":"jvasp-103950","created_at":"2022-09-04T14:36:58.136253Z","updated_at":"2022-09-04T14:36:58.136271Z","structure_string":"Hf1 H6 C5 O4\n1.0\n3.472438 -0.011171 0.389889\n1.504844 3.746903 0.588116\n0.052081 -0.000993 8.995598\nHf H C O\n1 6 5 4\ndirect\n0.075810 0.965186 0.328270 Hf\n0.561297 0.098275 0.908667 H\n0.906552 0.301996 0.913474 H\n0.885840 0.577249 0.602463 H\n0.826871 0.170366 0.659219 H\n0.069485 0.655588 0.771267 H\n0.403184 0.877702 0.776177 H\n0.457962 0.491135 0.482844 C\n0.654612 0.455903 0.630399 C\n0.400434 0.458780 0.068231 C\n0.395835 0.613084 0.772633 C\n0.573216 0.361216 0.912547 C\n0.745166 0.566557 0.344936 O\n0.480874 0.143745 0.460646 O\n0.201564 0.774710 0.095683 O\n0.481215 0.198049 0.175168 O\n","nsites":16,"nelements":4,"elements":["Hf","H","C","O"],"chemical_system":"C-H-Hf-O","density":4.3753154910573056,"density_atomic":0.13661556550980408,"volume":117.11696204084282,"volume_molar":4.408092692459578,"formula_full":"Hf1 H6 C5 O4","formula_reduced":"HfH6C5O4","formula_anonymous":"AB4C5D6","energy_above_hull":4.6859973125,"spacegroup":1},{"id":"jvasp-101970","created_at":"2022-09-04T14:37:03.550194Z","updated_at":"2022-09-04T14:37:03.550214Z","structure_string":"Sn2 H8 C4 Cl4\n1.0\n3.960457 0.004963 0.004854\n1.969007 5.897743 1.593839\n-0.011826 0.021973 10.401788\nSn H C Cl\n2 8 4 4\ndirect\n0.987391 0.972480 0.270653 Sn\n0.980478 0.972513 0.770646 Sn\n0.926828 0.743377 0.592761 H\n0.697436 0.201401 0.948589 H\n0.270439 0.743570 0.092719 H\n0.040989 0.201640 0.448533 H\n0.623504 0.150405 0.453914 H\n0.165962 0.150728 0.953876 H\n0.801903 0.794244 0.087432 H\n0.344328 0.794602 0.587377 H\n0.055611 0.874801 0.580355 C\n0.912221 0.070208 0.460938 C\n0.957744 0.070220 0.960942 C\n0.010127 0.874749 0.080365 C\n0.643079 0.670444 0.861298 Cl\n0.341333 0.274573 0.679986 Cl\n0.626510 0.670419 0.361319 Cl\n0.324768 0.274539 0.179989 Cl\n","nsites":18,"nelements":4,"elements":["Sn","H","C","Cl"],"chemical_system":"C-Cl-H-Sn","density":2.978282376188953,"density_atomic":0.07415874682831407,"volume":242.72254817994764,"volume_molar":8.120607504252924,"formula_full":"Sn2 H8 C4 Cl4","formula_reduced":"SnH4(CCl)2","formula_anonymous":"AB2C2D4","energy_above_hull":2.982983315,"spacegroup":15},{"id":"jvasp-106405","created_at":"2022-09-04T14:36:49.683232Z","updated_at":"2022-09-04T14:36:49.683258Z","structure_string":"Rb2 Cu1 Au1 F6\n1.0\n5.227668 -0.000000 3.018196\n1.742556 4.928693 3.018196\n-0.000000 -0.000000 6.036392\nRb Cu Au F\n2 1 1 6\ndirect\n0.750001 0.750000 0.750001 Rb\n0.250000 0.250000 0.250000 Rb\n0.500001 0.500000 0.500000 Cu\n0.000000 0.000000 0.000000 Au\n0.735100 0.264900 0.264901 F\n0.264900 0.264900 0.735100 F\n0.264901 0.735099 0.735100 F\n0.264901 0.735099 0.264901 F\n0.735100 0.264900 0.735100 F\n0.735101 0.735099 0.264901 F\n","nsites":10,"nelements":4,"elements":["Rb","Cu","Au","F"],"chemical_system":"Au-Cu-F-Rb","density":5.823415208561738,"density_atomic":0.06429582882600089,"volume":155.53108471565503,"volume_molar":9.366300847131592,"formula_full":"Rb2 Cu1 Au1 F6","formula_reduced":"Rb2CuAuF6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-101925","created_at":"2022-09-04T14:36:56.118528Z","updated_at":"2022-09-04T14:36:56.118555Z","structure_string":"Zn1 H16 C10 O4\n1.0\n3.876379 0.114344 0.305025\n1.738024 4.387864 0.236757\n-0.359835 0.247440 14.610310\nZn H C O\n1 16 10 4\ndirect\n0.201789 0.945329 0.165914 Zn\n0.263772 0.180822 0.525480 H\n0.407663 0.684388 0.949372 H\n0.919001 0.825865 0.952659 H\n0.313565 0.694544 0.766270 H\n0.831704 0.787131 0.787354 H\n0.175753 0.685212 0.590724 H\n0.704861 0.755017 0.620817 H\n0.014601 0.653843 0.418676 H\n0.553141 0.706819 0.454173 H\n0.462631 0.215035 0.869761 H\n0.981824 0.304689 0.887420 H\n0.386254 0.205575 0.694387 H\n0.915293 0.274226 0.722699 H\n0.127985 0.133160 0.359640 H\n0.684280 0.167611 0.400383 H\n0.801600 0.237191 0.559748 H\n0.171358 0.457808 0.048131 C\n0.172285 0.609816 0.953814 C\n0.187261 0.409832 0.873847 C\n0.106882 0.591314 0.781864 C\n0.104973 0.391476 0.703261 C\n0.839173 0.530410 0.444283 C\n0.979557 0.361188 0.535996 C\n0.842501 0.304729 0.373217 C\n0.674536 0.439207 0.281487 C\n0.986267 0.569398 0.611701 C\n0.054655 0.625341 0.117402 O\n0.721955 0.258243 0.216410 O\n0.476195 0.729771 0.275087 O\n0.278379 0.163561 0.053081 O\n","nsites":31,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":1.7932658087716349,"density_atomic":0.12602675285368647,"volume":245.9795186184804,"volume_molar":4.778462210314612,"formula_full":"Zn1 H16 C10 O4","formula_reduced":"ZnH16(C5O2)2","formula_anonymous":"AB4C10D16","energy_above_hull":4.538483690322581,"spacegroup":1},{"id":"jvasp-105376","created_at":"2022-09-04T14:36:56.122152Z","updated_at":"2022-09-04T14:36:56.122172Z","structure_string":"Ti2 Fe1 Ni1 Sb2\n1.0\n4.014634 -0.001945 5.972276\n1.819311 3.578743 5.972276\n-0.003173 -0.001945 7.196205\nTi Fe Ni Sb\n2 1 1 2\ndirect\n0.371894 0.371893 0.371895 Ti\n0.878859 0.878855 0.878860 Ti\n0.997102 0.997098 0.997104 Fe\n0.501092 0.501089 0.501092 Ni\n0.123633 0.123633 0.123633 Sb\n0.627424 0.627421 0.627425 Sb\n","nsites":6,"nelements":4,"elements":["Ti","Fe","Ni","Sb"],"chemical_system":"Fe-Ni-Sb-Ti","density":7.279934987629389,"density_atomic":0.05796588030249533,"volume":103.50916726682938,"volume_molar":10.389112920520516,"formula_full":"Ti2 Fe1 Ni1 Sb2","formula_reduced":"Ti2FeNiSb2","formula_anonymous":"ABC2D2","energy_above_hull":2.738902794444445,"spacegroup":160},{"id":"jvasp-51765","created_at":"2022-09-04T14:37:03.995261Z","updated_at":"2022-09-04T14:37:03.995294Z","structure_string":"H8 Pd1 N2 Cl6\n1.0\n4.879412 4.879412 0.000000\n-0.000000 4.879412 4.879412\n4.879412 -0.000000 4.879412\nH Pd N Cl\n8 1 2 6\ndirect\n0.933839 0.688720 0.688720 H\n0.311280 0.311280 0.311280 H\n0.311280 0.066161 0.311280 H\n0.311280 0.311280 0.066161 H\n0.000000 0.000000 0.000000 H\n0.688720 0.688720 0.688720 H\n0.688720 0.933839 0.688720 H\n0.688720 0.688720 0.933839 H\n0.066161 0.311280 0.311280 Pd\n0.750000 0.750000 0.750000 N\n0.250000 0.250000 0.250000 N\n0.759335 0.759335 0.240665 Cl\n0.240665 0.759335 0.759335 Cl\n0.240665 0.240665 0.759335 Cl\n0.240665 0.759335 0.240665 Cl\n0.759335 0.240665 0.240665 Cl\n0.759335 0.240665 0.759335 Cl\n","nsites":17,"nelements":4,"elements":["H","Pd","N","Cl"],"chemical_system":"Cl-H-N-Pd","density":2.5386792369594304,"density_atomic":0.07316720343577364,"volume":232.34453691977777,"volume_molar":8.230655918517167,"formula_full":"H8 Pd1 N2 Cl6","formula_reduced":"H8Pd(NCl3)2","formula_anonymous":"AB2C6D8","energy_above_hull":2.4095450944117647,"spacegroup":160},{"id":"jvasp-100388","created_at":"2022-09-04T14:36:58.163684Z","updated_at":"2022-09-04T14:36:58.163694Z","structure_string":"In1 Ga1 Ag2 Se4\n1.0\n5.523892 0.000161 -4.653176\n-1.195025 5.393079 -4.653176\n-0.000129 -0.000161 7.222563\nIn Ga Ag Se\n1 1 2 4\ndirect\n0.499999 0.500000 -0.000001 In\n0.749999 0.250000 0.499999 Ga\n0.249999 0.750000 0.499999 Ag\n0.000000 0.000000 0.000000 Ag\n0.104811 0.134475 0.501520 Se\n0.632954 0.603291 0.498478 Se\n0.396708 0.895189 0.029662 Se\n0.865524 0.367046 0.970335 Se\n","nsites":8,"nelements":4,"elements":["In","Ga","Ag","Se"],"chemical_system":"Ag-Ga-In-Se","density":5.526802089401306,"density_atomic":0.037181814207043404,"volume":215.15894720609273,"volume_molar":16.196468323106238,"formula_full":"In1 Ga1 Ag2 Se4","formula_reduced":"InGa(AgSe2)2","formula_anonymous":"ABC2D4","energy_above_hull":0.5454600352083333,"spacegroup":82},{"id":"jvasp-28511","created_at":"2022-09-04T14:36:59.744399Z","updated_at":"2022-09-04T14:36:59.744418Z","structure_string":"Te2 Mo2 W1 Se4\n1.0\n3.404714 -0.000004 -0.000433\n-1.702360 2.948630 0.003847\n-0.003434 0.033172 26.903967\nTe Mo W Se\n2 2 1 4\ndirect\n0.667301 0.335054 0.529559 Te\n0.666432 0.332651 0.668823 Te\n0.332964 0.665740 0.099782 Mo\n0.333546 0.667199 0.599261 Mo\n0.666806 0.333685 0.341909 W\n0.332838 0.665482 0.403450 Se\n0.667042 0.334148 0.038608 Se\n0.665560 0.330682 0.161046 Se\n0.334112 0.668562 0.280404 Se\n","nsites":9,"nelements":4,"elements":["Te","Mo","W","Se"],"chemical_system":"Mo-Se-Te-W","density":5.820666562720157,"density_atomic":0.03332162959235256,"volume":270.0948335991807,"volume_molar":18.072767849811594,"formula_full":"Te2 Mo2 W1 Se4","formula_reduced":"Te2Mo2WSe4","formula_anonymous":"AB2C2D4","energy_above_hull":3.542031199999999,"spacegroup":156},{"id":"jvasp-102829","created_at":"2022-09-04T14:36:49.690361Z","updated_at":"2022-09-04T14:36:49.690371Z","structure_string":"Sm2 Fe2 As2 O2\n1.0\n3.951865 -0.000000 0.000000\n0.000000 3.951865 0.000000\n-0.000000 -0.000000 8.273094\nSm Fe As O\n2 2 2 2\ndirect\n0.500001 0.000000 0.858064 Sm\n-0.000000 0.500001 0.141935 Sm\n0.000000 0.000000 0.500000 Fe\n0.500001 0.500001 0.500000 Fe\n0.500001 0.000000 0.350871 As\n-0.000000 0.500001 0.649129 As\n0.000000 0.000000 0.000000 O\n0.500001 0.500001 -0.000000 O\n","nsites":8,"nelements":4,"elements":["Sm","Fe","As","O"],"chemical_system":"As-Fe-O-Sm","density":7.63743611043441,"density_atomic":0.061918129437931874,"volume":129.2028695411314,"volume_molar":9.725973337157626,"formula_full":"Sm2 Fe2 As2 O2","formula_reduced":"SmFeAsO","formula_anonymous":"ABCD","energy_above_hull":1.94275240625,"spacegroup":129},{"id":"jvasp-103919","created_at":"2022-09-04T14:37:03.540404Z","updated_at":"2022-09-04T14:37:03.540436Z","structure_string":"Zn1 H10 C7 O4\n1.0\n3.894466 -0.249180 -0.520560\n-1.490020 4.498564 -0.001907\n-0.393737 0.143565 10.778183\nZn H C O\n1 10 7 4\ndirect\n0.156046 0.121790 0.186327 Zn\n0.440591 0.244354 0.553004 H\n0.374722 0.305380 0.788915 H\n0.833180 0.321954 0.839432 H\n0.071985 0.777161 0.707503 H\n0.614810 0.758085 0.656397 H\n0.573358 0.844550 0.879616 H\n0.019864 0.851149 0.932476 H\n0.704362 0.700805 0.426657 H\n0.160602 0.719157 0.484198 H\n0.889821 0.248876 0.610018 H\n0.827044 0.352036 0.353053 C\n0.869515 0.562636 0.462410 C\n0.733926 0.396253 0.578665 C\n0.779964 0.617204 0.686846 C\n0.667575 0.461247 0.807632 C\n0.727759 0.695951 0.911830 C\n0.605429 0.576943 0.034763 C\n0.717811 0.753113 0.132918 O\n0.081928 0.431143 0.286288 O\n0.537991 0.106048 0.330325 O\n0.373857 0.302588 0.034975 O\n","nsites":22,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":2.017378234023143,"density_atomic":0.11955426253169135,"volume":184.01686007780992,"volume_molar":5.037161061826346,"formula_full":"Zn1 H10 C7 O4","formula_reduced":"ZnH10C7O4","formula_anonymous":"AB4C7D10","energy_above_hull":4.367014745454545,"spacegroup":1},{"id":"jvasp-57430","created_at":"2022-09-04T14:37:02.534880Z","updated_at":"2022-09-04T14:37:02.534911Z","structure_string":"Ba4 Mn4 Bi4 O2\n1.0\n2.410161 -4.174522 0.000000\n2.410161 4.174522 -0.000000\n-0.000000 0.000000 20.151322\nBa Mn Bi O\n4 4 4 2\ndirect\n0.000000 0.000000 0.250000 Ba\n0.000000 0.000000 0.750000 Ba\n0.000000 0.000000 0.500000 Ba\n0.000000 0.000000 0.000000 Ba\n0.666667 0.333333 0.848644 Mn\n0.333333 0.666667 0.151356 Mn\n0.666667 0.333333 0.651356 Mn\n0.333333 0.666667 0.348644 Mn\n0.666667 0.333333 0.113102 Bi\n0.666667 0.333333 0.386898 Bi\n0.333333 0.666667 0.613102 Bi\n0.333333 0.666667 0.886898 Bi\n0.666667 0.333333 0.750000 O\n0.333333 0.666667 0.250000 O\n","nsites":14,"nelements":4,"elements":["Ba","Mn","Bi","O"],"chemical_system":"Ba-Bi-Mn-O","density":6.703571988757607,"density_atomic":0.0345256360799707,"volume":405.4957877552847,"volume_molar":17.44251936749578,"formula_full":"Ba4 Mn4 Bi4 O2","formula_reduced":"Ba2Mn2Bi2O","formula_anonymous":"AB2C2D2","energy_above_hull":1.861658360394088,"spacegroup":194},{"id":"jvasp-103893","created_at":"2022-09-04T14:36:59.733934Z","updated_at":"2022-09-04T14:36:59.733956Z","structure_string":"Ca2 H4 C6 O8\n1.0\n4.212989 0.042592 0.616793\n0.777921 6.470778 0.409421\n0.160332 0.145143 7.551046\nCa H C O\n2 4 6 8\ndirect\n0.937535 0.913063 0.513474 Ca\n0.937535 0.913063 0.013474 Ca\n0.158530 0.353699 0.191011 H\n0.158531 0.353699 0.691012 H\n0.118973 0.430433 0.407896 H\n0.118974 0.430433 0.907896 H\n0.299673 0.396378 0.789454 C\n0.299674 0.396378 0.289454 C\n0.513542 0.201091 0.831883 C\n0.426452 0.595865 0.710311 C\n0.426453 0.595867 0.210310 C\n0.513544 0.201090 0.331883 C\n0.229661 0.760546 0.251428 O\n0.686751 0.601380 0.103608 O\n0.686750 0.601380 0.603609 O\n0.402537 0.082915 0.465006 O\n0.402539 0.082915 0.965005 O\n0.789580 0.148743 0.241879 O\n0.789579 0.148742 0.741880 O\n0.229662 0.760546 0.751427 O\n","nsites":20,"nelements":4,"elements":["Ca","H","C","O"],"chemical_system":"C-Ca-H-O","density":2.304891011894629,"density_atomic":0.09766414633578081,"volume":204.7834415225179,"volume_molar":6.166173550829158,"formula_full":"Ca2 H4 C6 O8","formula_reduced":"CaH2C3O4","formula_anonymous":"AB2C3D4","energy_above_hull":3.748581442,"spacegroup":1}]}