{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=4333","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-spacegroup&page=4331","results":[{"id":"jvasp-118627","created_at":"2022-09-04T14:38:53.339228Z","updated_at":"2022-09-04T14:38:53.339258Z","structure_string":"Li1 O3\n1.0\n2.737723 -0.114957 0.534342\n-0.172867 -5.222087 -0.172366\n-0.932763 -2.386261 -2.803775\nLi O\n1 3\ndirect\n-0.030944 0.089233 0.894645 Li\n-0.031764 0.584776 0.892875 O\n0.195041 0.506726 0.349465 O\n0.749837 0.953595 0.456259 O\n","nsites":4,"nelements":2,"elements":["Li","O"],"chemical_system":"Li-O","density":2.4916772800085987,"density_atomic":0.1092497256158896,"volume":36.6133642665939,"volume_molar":5.512270832764566,"formula_full":"Li1 O3","formula_reduced":"LiO3","formula_anonymous":"AB3","energy_above_hull":1.7930101250000003,"spacegroup":8},{"id":"jvasp-120732","created_at":"2022-09-04T14:38:53.194381Z","updated_at":"2022-09-04T14:38:53.194414Z","structure_string":"Y4 Fe1 S7\n1.0\n6.266710 -0.011021 1.584214\n5.126527 3.604234 1.584214\n0.054726 0.017260 11.394068\nY Fe S\n4 1 7\ndirect\n0.691631 0.691629 0.212934 Y\n0.304953 0.304952 0.800228 Y\n0.997476 0.997474 0.007497 Y\n0.113161 0.113160 0.563111 Y\n0.888624 0.888622 0.424370 Fe\n0.747172 0.747171 0.635404 S\n0.274280 0.274279 0.353856 S\n0.335057 0.335057 0.053972 S\n0.658708 0.658706 0.947446 S\n0.030101 0.030101 0.229147 S\n0.964349 0.964347 0.783695 S\n0.494498 0.494497 0.488338 S\n","nsites":12,"nelements":3,"elements":["Y","Fe","S"],"chemical_system":"Fe-S-Y","density":4.09843442124458,"density_atomic":0.04657419240536205,"volume":257.653420923697,"volume_molar":12.93020973415027,"formula_full":"Y4 Fe1 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5.929125 -0.007380\n-0.000000 -0.001591 11.856947\nTb Ti Fe H\n2 2 22 1\ndirect\n0.002868 0.005736 0.002763 Tb\n0.502652 0.005306 0.502779 Tb\n0.312908 0.625818 0.313914 Ti\n0.814405 0.628813 0.813427 Ti\n0.175925 0.351852 0.176155 Fe\n0.322756 0.645513 0.679275 Fe\n0.821079 0.642160 0.178888 Fe\n0.179874 0.359750 0.822079 Fe\n0.678230 0.356462 0.321717 Fe\n0.500236 0.501178 0.001180 Fe\n-0.000210 0.500763 0.501432 Fe\n0.000941 0.501178 0.001180 Fe\n0.500973 0.500763 0.501432 Fe\n0.252082 0.003789 0.749564 Fe\n0.751707 0.003789 0.749564 Fe\n0.676720 0.353441 0.676576 Fe\n0.250015 0.001423 0.251407 Fe\n0.116967 0.233934 0.616179 Fe\n0.614560 0.229121 0.115324 Fe\n0.387126 0.774254 0.886222 Fe\n0.885301 0.770603 0.386174 Fe\n0.610278 0.220557 0.888786 Fe\n0.108701 0.217404 0.391178 Fe\n0.890840 0.781683 0.608738 Fe\n0.389109 0.778219 0.110290 Fe\n0.751407 0.001423 0.251407 Fe\n0.502539 0.005078 0.002367 H\n","nsites":27,"nelements":4,"elements":["Tb","Ti","Fe","H"],"chemical_system":"Fe-H-Tb-Ti","density":8.271928325665284,"density_atomic":0.081853186586554,"volume":329.8588744794853,"volume_molar":7.357246566854194,"formula_full":"Tb2 Ti2 Fe22 H1","formula_reduced":"Tb2Ti2Fe22H","formula_anonymous":"AB2C2D22","energy_above_hull":4.203098683950617,"spacegroup":8},{"id":"jvasp-118726","created_at":"2022-09-04T14:38:53.596374Z","updated_at":"2022-09-04T14:38:53.596406Z","structure_string":"Mg1 Ta1 O3\n1.0\n2.772973 -2.947920 0.037861\n2.772973 2.947920 0.037861\n-0.708743 0.000000 3.961454\nMg Ta O\n1 1 3\ndirect\n0.474591 0.474591 0.680465 Mg\n0.030764 0.030764 0.949566 Ta\n0.531467 0.018549 0.909181 O\n0.018549 0.531467 0.909181 O\n0.057988 0.057988 0.438253 O\n","nsites":5,"nelements":3,"elements":["Mg","Ta","O"],"chemical_system":"Mg-O-Ta","density":6.477312839670688,"density_atomic":0.07701307666789078,"volume":64.9240390896454,"volume_molar":7.819634042111739,"formula_full":"Mg1 Ta1 O3","formula_reduced":"MgTaO3","formula_anonymous":"ABC3","energy_above_hull":2.27639575,"spacegroup":8},{"id":"jvasp-120335","created_at":"2022-09-04T14:38:52.905002Z","updated_at":"2022-09-04T14:38:52.905028Z","structure_string":"Mg2 Se2\n1.0\n4.321654 -0.005553 1.090705\n2.817202 -6.391607 -1.957924\n-1.480150 2.284258 -3.128889\nMg Se\n2 2\ndirect\n0.132305 0.068110 0.192047 Mg\n0.632479 0.568147 -0.307168 Mg\n0.007014 0.454273 0.323443 Se\n0.506832 0.954219 0.822653 Se\n","nsites":4,"nelements":2,"elements":["Mg","Se"],"chemical_system":"Mg-Se","density":3.3494408866681256,"density_atomic":0.03906610079656275,"volume":102.39056159789415,"volume_molar":15.415259360949229,"formula_full":"Mg2 Se2","formula_reduced":"MgSe","formula_anonymous":"AB","energy_above_hull":0.0141949999999999,"spacegroup":8},{"id":"jvasp-120422","created_at":"2022-09-04T14:38:52.807372Z","updated_at":"2022-09-04T14:38:52.807402Z","structure_string":"Li8 Mn2 Co4 O14\n1.0\n4.957778 -0.008550 0.576966\n4.154977 2.704774 0.576966\n-0.012305 -0.003641 17.490970\nLi Mn Co O\n8 2 4 14\ndirect\n0.294476 0.294475 0.931293 Li\n0.856587 0.856584 0.776304 Li\n0.408868 0.408867 0.625283 Li\n-0.002956 -0.002956 0.501135 Li\n0.567312 0.567310 0.360931 Li\n0.142039 0.142038 0.220227 Li\n0.720151 0.720149 0.078668 Li\n0.710123 0.710121 0.562205 Li\n0.007409 0.007409 0.006073 Mn\n0.580143 0.580141 0.860400 Mn\n0.856428 0.856425 0.285134 Co\n0.431355 0.431354 0.145578 Co\n0.132729 0.132728 0.697572 Co\n0.282802 0.282800 0.427639 Co\n0.063141 0.063140 0.108562 O\n0.374452 0.374451 0.040922 O\n0.948737 0.948734 0.903614 O\n0.514286 0.514284 0.765326 O\n0.058536 0.058536 0.608816 O\n0.656171 0.656168 0.454969 O\n0.229593 0.229592 0.320158 O\n0.804147 0.804144 0.180642 O\n0.208656 0.208655 0.834073 O\n0.770808 0.770805 0.680605 O\n0.350069 0.350068 0.520635 O\n0.910659 0.910656 0.385868 O\n0.485125 0.485123 0.247137 O\n0.638189 0.638187 0.970239 O\n","nsites":28,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.413658405744303,"density_atomic":0.11905245996295337,"volume":235.19043628928804,"volume_molar":5.058392545499658,"formula_full":"Li8 Mn2 Co4 O14","formula_reduced":"Li4MnCo2O7","formula_anonymous":"AB2C4D7","energy_above_hull":2.5594952529556654,"spacegroup":8},{"id":"jvasp-120000","created_at":"2022-09-04T14:38:52.602394Z","updated_at":"2022-09-04T14:38:52.602411Z","structure_string":"Bi1 O3\n1.0\n3.882863 0.139239 0.796281\n0.828400 -4.837596 1.141127\n-1.621411 1.022611 -3.491008\nBi O\n1 3\ndirect\n0.478505 0.708454 0.477045 Bi\n0.185136 0.813610 0.876454 O\n0.806531 0.377480 0.819359 O\n0.594859 0.265365 -0.081938 O\n","nsites":4,"nelements":2,"elements":["Bi","O"],"chemical_system":"Bi-O","density":7.672543792315297,"density_atomic":0.0719206015139851,"volume":55.616887453620535,"volume_molar":8.37331812196952,"formula_full":"Bi1 O3","formula_reduced":"BiO3","formula_anonymous":"AB3","energy_above_hull":1.8472962000000004,"spacegroup":8},{"id":"jvasp-119389","created_at":"2022-09-04T14:38:52.423430Z","updated_at":"2022-09-04T14:38:52.423454Z","structure_string":"Li4 Ti5 Co3 O16\n1.0\n5.733970 -0.027825 0.031761\n2.792439 5.008140 0.031761\n-0.000394 -0.000230 9.487742\nLi Ti Co O\n4 5 3 16\ndirect\n0.332817 0.332818 0.108759 Li\n0.011324 0.011324 0.007440 Li\n0.008111 0.008111 0.503805 Li\n0.663119 0.663120 0.598093 Li\n0.824497 0.824498 0.276348 Ti\n0.651032 0.159316 0.781123 Ti\n0.335269 0.335269 0.497820 Ti\n0.159316 0.651031 0.781123 Ti\n0.654294 0.654294 0.007654 Ti\n0.343541 0.833236 0.287616 Co\n0.174624 0.174623 0.788375 Co\n0.833235 0.343542 0.287616 Co\n0.832763 0.832764 0.904816 O\n0.827012 0.335409 0.905568 O\n0.665354 0.665355 0.396115 O\n0.517455 0.967977 0.159253 O\n0.967976 0.517456 0.159253 O\n0.169778 0.169778 0.396731 O\n0.031734 0.488911 0.652690 O\n0.481999 0.481999 0.664428 O\n0.171839 0.671593 0.403280 O\n0.006928 0.006928 0.194865 O\n0.004487 0.004487 0.693612 O\n0.335845 0.335845 0.901775 O\n0.521391 0.521392 0.170850 O\n0.671593 0.171840 0.403280 O\n0.488912 0.031734 0.652690 O\n0.335409 0.827012 0.905568 O\n","nsites":28,"nelements":4,"elements":["Li","Ti","Co","O"],"chemical_system":"Co-Li-O-Ti","density":4.254121353047618,"density_atomic":0.10249192491531744,"volume":273.1922541520673,"volume_molar":5.8757221751622986,"formula_full":"Li4 Ti5 Co3 O16","formula_reduced":"Li4Ti5Co3O16","formula_anonymous":"A3B4C5D16","energy_above_hull":3.1336960845238093,"spacegroup":8},{"id":"jvasp-118991","created_at":"2022-09-04T14:38:52.409035Z","updated_at":"2022-09-04T14:38:52.409062Z","structure_string":"Li8 Mn2 Co4 O14\n1.0\n2.827432 0.035946 -0.187317\n-0.055301 4.978128 0.090787\n-0.346663 0.314301 16.380651\nLi Mn Co O\n8 2 4 14\ndirect\n0.925205 0.357853 0.850333 Li\n0.352072 0.228493 0.703645 Li\n0.784313 0.070256 0.567673 Li\n0.217209 0.924291 0.434338 Li\n0.646942 0.789647 0.294076 Li\n0.074188 0.638359 0.148858 Li\n0.500917 0.493495 0.002184 Li\n0.285125 0.573095 0.569976 Li\n0.000391 -0.002436 0.000992 Mn\n0.428183 0.852607 0.856803 Mn\n0.142996 0.287606 0.285849 Co\n0.571872 0.138732 0.143869 Co\n0.854603 0.714983 0.709492 Co\n0.716164 0.434097 0.431789 Co\n0.534564 0.837319 0.068857 O\n0.465658 0.156031 0.932051 O\n0.895941 0.011569 0.792763 O\n0.325299 0.877510 0.651322 O\n0.746528 0.733908 0.492569 O\n0.179221 0.577982 0.358452 O\n0.607650 0.433358 0.215674 O\n0.036580 0.291163 0.073763 O\n0.392816 0.564446 0.785528 O\n0.824189 0.416848 0.648425 O\n0.245916 0.269437 0.490789 O\n0.676045 0.143078 0.351461 O\n0.105521 -0.007440 0.210667 O\n0.963901 0.693727 0.927801 O\n","nsites":28,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.509465616393132,"density_atomic":0.1216367297594304,"volume":230.19362700212005,"volume_molar":4.950922942363229,"formula_full":"Li8 Mn2 Co4 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-1.133977\n-0.042576 4.086468 -0.132962\n-0.139509 -0.201565 5.660962\nSm P\n1 3\ndirect\n0.338755 -0.017970 0.677511 Sm\n0.620630 0.078300 0.241258 P\n0.122261 0.442185 0.244522 P\n0.918353 0.497488 0.836707 P\n","nsites":4,"nelements":2,"elements":["Sm","P"],"chemical_system":"P-Sm","density":4.976838652300502,"density_atomic":0.04927830398647225,"volume":81.17162476001751,"volume_molar":12.220673750568166,"formula_full":"Sm1 P3","formula_reduced":"SmP3","formula_anonymous":"AB3","energy_above_hull":2.41805884375,"spacegroup":8}]}