{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=39","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=spacegroup&page=37","results":[{"id":"jvasp-103922","created_at":"2022-09-04T14:37:07.702987Z","updated_at":"2022-09-04T14:37:07.703014Z","structure_string":"Zn1 H10 C7 O4\n1.0\n3.984261 -0.089927 0.998567\n2.263632 3.978225 0.677652\n0.191073 -0.356537 11.654953\nZn H C O\n1 10 7 4\ndirect\n0.820449 0.869417 0.816495 Zn\n0.266747 0.101557 0.430833 H\n0.417003 0.121091 0.200851 H\n0.926301 0.307339 0.202311 H\n0.799469 0.781837 0.323888 H\n0.290810 0.598431 0.320292 H\n0.437768 0.637361 0.102249 H\n0.954643 0.817017 0.099565 H\n0.134685 0.624048 0.534865 H\n0.645169 0.758629 0.556720 H\n0.772635 0.286696 0.438043 H\n0.929760 0.341385 0.659839 C\n0.927569 0.533194 0.544562 C\n0.006289 0.343394 0.433721 C\n0.060364 0.539545 0.320947 C\n0.156448 0.362712 0.204891 C\n0.213252 0.575572 0.098212 C\n0.331328 0.432629 0.975178 C\n0.282866 0.635823 0.888611 O\n0.980338 0.426623 0.750198 O\n0.884807 0.085476 0.661800 O\n0.488807 0.117540 0.964355 O\n","nsites":22,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":1.9905940077669384,"density_atomic":0.11796697048920878,"volume":186.4928793946818,"volume_molar":5.104938047511261,"formula_full":"Zn1 H10 C7 O4","formula_reduced":"ZnH10C7O4","formula_anonymous":"AB4C7D10","energy_above_hull":4.367237018181818,"spacegroup":1},{"id":"jvasp-101799","created_at":"2022-09-04T14:37:07.768578Z","updated_at":"2022-09-04T14:37:07.768598Z","structure_string":"H12 C12 S2 O2\n1.0\n5.634312 -0.096339 1.126032\n0.299914 6.939423 2.038735\n-0.077969 -0.046931 7.495953\nH C S O\n12 12 2 2\ndirect\n0.672919 0.037573 0.794543 H\n0.235380 0.246518 0.427980 H\n0.400974 0.125525 0.088380 H\n0.565298 0.053390 0.431010 H\n0.749747 0.316428 0.359996 H\n0.831053 0.249832 0.942855 H\n0.309512 0.225343 0.800862 H\n0.058321 0.570691 0.814978 H\n0.070114 0.385240 0.572602 H\n0.152175 0.301199 0.113690 H\n0.984153 0.942703 0.747450 H\n0.974210 0.641971 0.268192 H\n0.647844 0.773221 0.383333 C\n0.246439 0.318793 0.537694 C\n0.339652 0.275966 0.065168 C\n0.709726 0.966574 0.367878 C\n0.796267 0.914539 0.799449 C\n0.721890 0.732336 0.864144 C\n0.667443 0.450359 0.384908 C\n0.497275 0.418559 0.992436 C\n0.789203 0.622678 0.336070 C\n0.867983 0.559496 0.865050 C\n0.749916 0.393417 0.931098 C\n0.431340 0.469474 0.466415 C\n0.424839 0.666382 0.959780 S\n0.363385 0.699177 0.483168 S\n0.905307 0.036423 0.293388 O\n0.301358 0.168726 0.696505 O\n","nsites":28,"nelements":4,"elements":["H","C","S","O"],"chemical_system":"C-H-O-S","density":1.4231428286332208,"density_atomic":0.09509328391784197,"volume":294.4477133021428,"volume_molar":6.332877057020101,"formula_full":"H12 C12 S2 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0.847965 F\n0.447521 0.832471 0.350821 F\n0.433932 0.147699 0.052766 F\n0.031421 0.931471 0.792758 F\n0.523804 0.385271 0.310066 F\n0.913500 0.012868 0.209584 F\n0.921201 0.652888 0.542373 F\n0.498499 0.089526 0.612689 F\n","nsites":20,"nelements":4,"elements":["Li","Mn","O","F"],"chemical_system":"F-Li-Mn-O","density":3.695468807182653,"density_atomic":0.0855133315969709,"volume":233.8816606311296,"volume_molar":7.042341407516064,"formula_full":"Li3 Mn5 O1 F11","formula_reduced":"Li3Mn5OF11","formula_anonymous":"AB3C5D11","energy_above_hull":1.3965186407198271,"spacegroup":1},{"id":"jvasp-101800","created_at":"2022-09-04T14:37:08.371057Z","updated_at":"2022-09-04T14:37:08.371074Z","structure_string":"H8 C14 S4 O2\n1.0\n3.962193 0.033696 0.626790\n0.235164 8.165744 2.367166\n0.098067 -0.078464 10.183347\nH C S O\n8 14 4 2\ndirect\n0.732287 0.079810 0.854766 H\n0.232283 0.579810 0.354766 H\n0.630251 0.310159 0.468843 H\n0.130252 0.810159 0.968843 H\n0.937631 0.144592 0.295314 H\n0.437632 0.644592 0.795314 H\n0.409882 0.193748 0.771502 H\n0.909878 0.693748 0.271501 H\n0.816275 0.334836 0.772409 C\n0.316272 0.834835 0.272408 C\n0.810063 0.343355 0.918651 C\n0.310062 0.843354 0.418652 C\n0.188060 0.676247 0.261787 C\n0.688063 0.176247 0.761787 C\n0.323632 0.623707 0.134084 C\n0.613735 0.468098 0.971465 C\n0.113736 0.968096 0.471465 C\n0.280117 0.697441 0.998439 C\n0.780118 0.197441 0.498439 C\n0.441953 0.608649 0.905981 C\n0.941951 0.108649 0.405981 C\n0.823633 0.123708 0.634084 C\n0.065982 0.945879 0.648102 S\n0.565981 0.445880 0.148101 S\n0.487374 0.982233 0.147749 S\n0.987376 0.482233 0.647749 S\n0.487269 0.736685 0.489151 O\n0.987270 0.236686 0.989152 O\n","nsites":28,"nelements":4,"elements":["H","C","S","O"],"chemical_system":"C-H-O-S","density":1.6950368801297193,"density_atomic":0.08494523091353896,"volume":329.6241554572928,"volume_molar":7.089439507356926,"formula_full":"H8 C14 S4 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O\n","nsites":20,"nelements":3,"elements":["Mo","H","O"],"chemical_system":"H-Mo-O","density":3.0714881857420226,"density_atomic":0.10277858336973389,"volume":194.5930693367542,"volume_molar":5.859334272331869,"formula_full":"Mo2 H8 O10","formula_reduced":"MoH4O5","formula_anonymous":"AB4C5","energy_above_hull":3.25327834,"spacegroup":1},{"id":"jvasp-11321","created_at":"2022-09-04T14:37:08.622703Z","updated_at":"2022-09-04T14:37:08.622729Z","structure_string":"Zn2 Sb2 F10\n1.0\n5.152903 0.191607 1.218077\n-1.392738 4.788259 0.695479\n0.057869 -1.292264 7.943801\nZn Sb F\n2 2 10\ndirect\n0.383976 0.556674 0.222189 Zn\n0.732943 0.574151 0.781469 Zn\n0.043074 0.082920 0.013871 Sb\n0.480314 0.073090 0.513767 Sb\n0.070883 0.840476 0.788995 F\n0.784009 -0.022596 0.344810 F\n0.605787 0.875664 0.686250 F\n0.817612 0.256634 0.901831 F\n0.350623 0.325761 0.841998 F\n0.785119 0.394133 0.557653 F\n0.635367 0.741073 0.026926 F\n0.320395 0.657863 0.454872 F\n0.059451 0.481541 0.135327 F\n0.416601 0.178632 0.232096 F\n","nsites":14,"nelements":3,"elements":["Zn","Sb","F"],"chemical_system":"F-Sb-Zn","density":4.579732090462092,"density_atomic":0.06842140769357001,"volume":204.61432279645524,"volume_molar":8.801544667088073,"formula_full":"Zn2 Sb2 F10","formula_reduced":"ZnSbF5","formula_anonymous":"ABC5","energy_above_hull":0.0,"spacegroup":1},{"id":"jvasp-101906","created_at":"2022-09-04T14:37:08.770355Z","updated_at":"2022-09-04T14:37:08.770371Z","structure_string":"Zn1 H6 C5 O4\n1.0\n3.885842 0.207391 -0.089895\n1.446823 4.436020 0.287816\n-0.666265 0.015568 8.326923\nZn H C O\n1 6 5 4\ndirect\n0.966844 0.738697 0.754514 Zn\n-0.002822 0.366586 0.370063 H\n0.447870 0.351169 0.439564 H\n0.283491 0.907346 0.206283 H\n0.093058 0.456514 0.084884 H\n0.728406 0.907672 0.274477 H\n0.537846 0.448838 0.145649 H\n0.322547 -0.011763 0.537953 C\n0.287794 0.210376 0.395849 C\n0.435067 0.055957 0.245591 C\n0.383624 0.299530 0.109128 C\n0.511910 0.186592 0.950588 C\n0.064015 0.061696 0.627419 O\n0.610495 0.740121 0.564913 O\n0.739468 0.909473 0.950143 O\n0.407674 0.370628 0.823421 O\n","nsites":16,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":2.307160727125354,"density_atomic":0.1137063660763042,"volume":140.713317575051,"volume_molar":5.29622128277212,"formula_full":"Zn1 H6 C5 O4","formula_reduced":"ZnH6C5O4","formula_anonymous":"AB4C5D6","energy_above_hull":4.145520274999999,"spacegroup":1},{"id":"jvasp-101849","created_at":"2022-09-04T14:37:08.888558Z","updated_at":"2022-09-04T14:37:08.888588Z","structure_string":"H6 C12 S4 N2 O2\n1.0\n4.590250 0.043249 0.539146\n1.846374 7.021522 2.394235\n0.139998 0.008705 9.760758\nH C S N O\n6 12 4 2 2\ndirect\n0.527480 0.480654 0.280104 H\n0.527481 0.980653 0.780104 H\n0.855521 0.302881 0.097937 H\n0.855522 0.802880 0.597937 H\n0.857082 0.882492 0.082630 H\n0.857084 0.382492 0.582630 H\n0.618740 0.928122 0.303883 C\n0.618741 0.428122 0.803883 C\n0.900128 0.768469 0.297622 C\n0.900129 0.268468 0.797622 C\n0.221066 0.148296 0.604511 C\n0.221064 0.648296 0.104511 C\n0.526703 0.478446 0.933523 C\n0.646460 0.914153 0.571544 C\n0.646459 0.414153 0.071544 C\n0.474518 0.009254 0.668634 C\n0.474516 0.509255 0.168634 C\n0.526703 0.978446 0.433523 C\n0.413686 0.539753 0.656448 S\n0.413686 0.039754 0.156448 S\n0.195409 0.661995 0.925774 S\n0.195409 0.161996 0.425773 S\n0.994979 0.773016 0.157008 N\n0.994980 0.273016 0.657008 N\n0.024258 0.145411 0.904334 O\n0.024256 0.645411 0.404334 O\n","nsites":26,"nelements":5,"elements":["H","C","S","N","O"],"chemical_system":"C-H-N-O-S","density":1.7943292711682641,"density_atomic":0.0830107107535677,"volume":313.21259345900194,"volume_molar":7.254655098518326,"formula_full":"H6 C12 S4 N2 O2","formula_reduced":"H3C6S2NO","formula_anonymous":"ABC2D3E6","energy_above_hull":5.221475903846153,"spacegroup":1},{"id":"jvasp-9510","created_at":"2022-09-04T14:37:09.057001Z","updated_at":"2022-09-04T14:37:09.057021Z","structure_string":"Mg2 Fe2 P2 O10\n1.0\n5.325459 0.040586 -0.008478\n-1.033583 5.232879 0.047639\n-1.777667 -2.123690 6.279611\nMg Fe P O\n2 2 2 10\ndirect\n0.384875 0.238426 0.809213 Mg\n0.757121 0.887788 0.319070 Mg\n-0.003263 0.508671 0.510273 Fe\n0.014689 0.484239 0.011628 Fe\n0.637361 0.827079 0.756097 P\n0.342970 0.130639 0.256960 P\n0.657682 0.604375 0.863165 O\n0.803642 0.809671 0.601803 O\n0.308613 0.284845 0.092218 O\n0.127104 0.154879 0.369545 O\n0.631622 0.233137 0.422997 O\n0.336265 0.835550 0.149080 O\n0.339865 0.816513 0.637082 O\n0.730080 0.109364 0.923992 O\n0.914770 0.579348 0.258609 O\n0.084591 0.414227 0.751135 O\n","nsites":16,"nelements":4,"elements":["Mg","Fe","P","O"],"chemical_system":"Fe-Mg-O-P","density":3.612597252040684,"density_atomic":0.09106522573825424,"volume":175.69824123632296,"volume_molar":6.612997125059833,"formula_full":"Mg2 Fe2 P2 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O\n","nsites":17,"nelements":4,"elements":["Li","Nb","Te","O"],"chemical_system":"Li-Nb-O-Te","density":5.557244868743555,"density_atomic":0.0843309813583523,"volume":201.58664972438729,"volume_molar":7.141077529276915,"formula_full":"Li1 Nb1 Te3 O12","formula_reduced":"LiNb(TeO4)3","formula_anonymous":"ABC3D12","energy_above_hull":2.7052814529411764,"spacegroup":1},{"id":"jvasp-103925","created_at":"2022-09-04T14:37:09.154267Z","updated_at":"2022-09-04T14:37:09.154286Z","structure_string":"Zn1 H12 C8 O4\n1.0\n4.445473 0.127737 0.562585\n1.220690 4.482921 -0.135720\n0.461507 -0.078519 11.227056\nZn H C O\n1 12 8 4\ndirect\n-0.010901 0.033018 0.820749 Zn\n0.022294 0.694655 0.515211 H\n0.817170 0.352840 0.115157 H\n0.503743 0.407575 0.035790 H\n0.415940 0.519492 0.316684 H\n0.105245 0.568110 0.234294 H\n0.211929 0.069449 0.390864 H\n0.699931 0.743218 0.437346 H\n0.613777 0.900503 0.197500 H\n0.300263 0.954198 0.115964 H\n0.831240 0.253826 0.580024 H\n0.493611 0.282391 0.511612 H\n0.897635 0.114602 0.310503 H\n0.849864 0.619928 0.965170 C\n0.654691 0.525290 0.071732 C\n0.457450 0.786890 0.163001 C\n0.258904 0.686058 0.268777 C\n0.862627 0.856638 0.467236 C\n0.672838 0.130471 0.555491 C\n0.498219 0.041854 0.668355 C\n0.057143 0.950007 0.358264 C\n-0.056184 0.463890 0.864181 O\n0.575325 0.054364 0.771969 O\n0.253764 0.958775 0.658018 O\n0.912471 0.870266 0.978470 O\n","nsites":25,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":1.7874634380969276,"density_atomic":0.11326729454865611,"volume":220.71684593173342,"volume_molar":5.316751657216528,"formula_full":"Zn1 H12 C8 O4","formula_reduced":"ZnH12(C2O)4","formula_anonymous":"AB4C8D12","energy_above_hull":4.437887776,"spacegroup":1}]}