{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3468","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3466","results":[{"id":"jvasp-112168","created_at":"2022-09-04T14:38:43.429035Z","updated_at":"2022-09-04T14:38:43.429067Z","structure_string":"Cd1 H4 C4 O4\n1.0\n3.676745 -0.134560 0.013331\n-0.826828 4.368357 -1.484192\n0.474636 -0.098655 7.573698\nCd H C O\n1 4 4 4\ndirect\n0.250570 0.744028 0.726473 Cd\n0.996450 0.033788 0.252633 H\n0.541338 0.904068 0.165660 H\n-0.040358 0.583985 0.287270 H\n0.504551 0.454255 0.200268 H\n0.588301 0.160611 0.458452 C\n0.728243 0.104294 0.258910 C\n0.772761 0.383756 0.194004 C\n0.912758 0.327486 0.994475 C\n0.372830 0.934758 0.490514 O\n0.685645 0.430661 0.583111 O\n0.815493 0.057462 0.869783 O\n0.128205 0.553392 0.962456 O\n","nsites":13,"nelements":4,"elements":["Cd","H","C","O"],"chemical_system":"C-Cd-H-O","density":3.153014546810126,"density_atomic":0.10803538717476595,"volume":120.33094285088504,"volume_molar":5.574229812550349,"formula_full":"Cd1 H4 C4 O4","formula_reduced":"CdH4(CO)4","formula_anonymous":"AB4C4D4","energy_above_hull":3.929785673076924,"spacegroup":2},{"id":"jvasp-120554","created_at":"2022-09-04T14:38:45.491339Z","updated_at":"2022-09-04T14:38:45.491365Z","structure_string":"Nb4 O9\n1.0\n4.749720 -0.014869 -1.663073\n-0.691441 5.303838 -1.539431\n0.045821 -0.083799 6.965668\nNb O\n4 9\ndirect\n0.368616 0.258336 0.279252 Nb\n0.157240 0.213445 0.736641 Nb\n0.601609 0.723286 0.701990 Nb\n0.889963 0.753201 0.265117 Nb\n0.127088 0.129606 0.412755 O\n0.257443 0.645698 0.406390 O\n0.871719 0.878930 0.595525 O\n0.872077 0.717652 0.974158 O\n0.098703 0.256968 0.002506 O\n0.310445 0.546574 0.772899 O\n0.567517 0.979161 0.241299 O\n0.665292 0.464887 0.230211 O\n0.486280 0.060273 0.791945 O\n","nsites":13,"nelements":2,"elements":["Nb","O"],"chemical_system":"Nb-O","density":4.889767530698366,"density_atomic":0.07424250409940406,"volume":175.10185247246196,"volume_molar":8.11144617635323,"formula_full":"Nb4 O9","formula_reduced":"Nb4O9","formula_anonymous":"A4B9","energy_above_hull":3.9352714692307686,"spacegroup":1},{"id":"jvasp-120409","created_at":"2022-09-04T14:38:49.851700Z","updated_at":"2022-09-04T14:38:49.851733Z","structure_string":"Tb1 Nb6 Sn6\n1.0\n5.807089 0.000000 0.000000\n-2.903545 5.029087 0.000000\n0.000000 -0.000000 9.628961\nTb Nb Sn\n1 6 6\ndirect\n0.000000 0.000000 0.000000 Tb\n0.000001 0.500000 0.750661 Nb\n0.500001 0.500000 0.750661 Nb\n0.500000 -0.000000 0.750661 Nb\n0.000001 0.500000 0.249339 Nb\n0.500001 0.500000 0.249339 Nb\n0.500000 -0.000000 0.249339 Nb\n0.666667 0.333334 0.500000 Sn\n0.333334 0.666667 0.500000 Sn\n0.666667 0.333334 -0.000000 Sn\n0.333334 0.666667 -0.000000 Sn\n0.000000 0.000000 0.673907 Sn\n0.000000 0.000000 0.326093 Sn\n","nsites":13,"nelements":3,"elements":["Tb","Nb","Sn"],"chemical_system":"Nb-Sn-Tb","density":8.436064045634284,"density_atomic":0.046229191035404876,"volume":281.2076030065912,"volume_molar":13.026705908368399,"formula_full":"Tb1 Nb6 Sn6","formula_reduced":"Tb(NbSn)6","formula_anonymous":"AB6C6","energy_above_hull":3.4639903846153848,"spacegroup":191},{"id":"jvasp-121966","created_at":"2022-09-04T14:38:54.130825Z","updated_at":"2022-09-04T14:38:54.130862Z","structure_string":"Li6 P1 Br1 O5\n1.0\n5.082062 -0.000000 2.934130\n1.694021 4.791414 2.934130\n-0.000000 -0.000000 5.868260\nLi P Br O\n6 1 1 5\ndirect\n0.983193 0.516807 0.983193 Li\n0.516807 0.983192 0.983193 Li\n0.516807 0.516807 0.983193 Li\n0.516807 0.983192 0.516808 Li\n0.983193 0.983192 0.516808 Li\n0.983193 0.516807 0.516808 Li\n0.500000 0.500000 0.500000 P\n0.000000 0.000000 0.000000 Br\n0.824854 0.391715 0.391716 O\n0.391716 0.824854 0.391716 O\n0.391715 0.391715 0.391716 O\n0.391715 0.391715 0.824855 O\n0.750000 0.749999 0.750000 O\n","nsites":13,"nelements":4,"elements":["Li","P","Br","O"],"chemical_system":"Br-Li-O-P","density":2.702077685370474,"density_atomic":0.09097673532823339,"volume":142.89367444432386,"volume_molar":6.619429393979486,"formula_full":"Li6 P1 Br1 O5","formula_reduced":"Li6PBrO5","formula_anonymous":"ABC5D6","energy_above_hull":1.626072085,"spacegroup":216},{"id":"jvasp-111659","created_at":"2022-09-04T14:38:50.682525Z","updated_at":"2022-09-04T14:38:50.682554Z","structure_string":"Li2 Mn3 F8\n1.0\n5.325446 -0.103213 0.013490\n-2.669401 4.886282 -1.792371\n-0.005468 -0.025685 5.960595\nLi Mn F\n2 3 8\ndirect\n0.459914 0.911966 0.257183 Li\n0.540087 0.088033 0.742818 Li\n0.000000 0.000000 0.000000 Mn\n0.227971 0.466795 0.653387 Mn\n0.772029 0.533204 0.346613 Mn\n0.219724 0.767329 0.953130 F\n0.223918 0.743561 0.465540 F\n0.312932 0.247637 0.323785 F\n0.290308 0.233133 0.817294 F\n0.709693 0.766866 0.182706 F\n0.687068 0.752362 0.676215 F\n0.776082 0.256438 0.534460 F\n0.780277 0.232670 0.046871 F\n","nsites":13,"nelements":3,"elements":["Li","Mn","F"],"chemical_system":"F-Li-Mn","density":3.583882275178361,"density_atomic":0.08484683518910367,"volume":153.21726462779728,"volume_molar":7.097661034236648,"formula_full":"Li2 Mn3 F8","formula_reduced":"Li2Mn3F8","formula_anonymous":"A2B3C8","energy_above_hull":1.0186564603183024,"spacegroup":2},{"id":"jvasp-112167","created_at":"2022-09-04T14:38:44.972930Z","updated_at":"2022-09-04T14:38:44.972946Z","structure_string":"Cd1 H4 C4 O4\n1.0\n3.790880 0.006821 0.048840\n0.377659 4.247213 0.730990\n0.106246 0.423089 7.854640\nCd H C O\n1 4 4 4\ndirect\n0.385836 0.655452 0.249412 Cd\n0.659404 0.074571 0.670334 H\n0.099819 -0.000305 0.741005 H\n0.585448 0.547308 0.816076 H\n0.031383 0.472970 0.881737 H\n0.013790 0.404695 0.538432 C\n0.885401 0.190549 0.702988 C\n0.800884 0.359314 0.852371 C\n0.700127 0.132463 0.018013 C\n0.919456 0.359925 0.389733 O\n0.231593 0.607489 0.546271 O\n0.849930 0.848513 0.055602 O\n0.449635 0.214440 0.116310 O\n","nsites":13,"nelements":4,"elements":["Cd","H","C","O"],"chemical_system":"C-Cd-H-O","density":3.0289742642740753,"density_atomic":0.10378525139197771,"volume":125.25864538210158,"volume_molar":5.802501491522612,"formula_full":"Cd1 H4 C4 O4","formula_reduced":"CdH4(CO)4","formula_anonymous":"AB4C4D4","energy_above_hull":3.930243365384616,"spacegroup":1},{"id":"jvasp-111737","created_at":"2022-09-04T14:38:54.032005Z","updated_at":"2022-09-04T14:38:54.032032Z","structure_string":"Na3 Eu2 Ge2 Se6\n1.0\n7.254895 0.039341 1.153411\n-3.854690 6.146254 1.153411\n0.090785 0.165155 7.630795\nNa Eu Ge Se\n3 2 2 6\ndirect\n0.666072 0.333928 -0.000000 Na\n0.333928 0.666071 -0.000000 Na\n0.000000 0.000000 0.000000 Na\n0.833382 0.166618 0.500000 Eu\n0.166618 0.833382 0.500000 Eu\n0.559140 0.559139 0.320729 Ge\n0.440860 0.440861 0.679271 Ge\n0.219144 0.219144 0.253420 Se\n0.780856 0.780856 0.746580 Se\n0.582653 0.940722 0.261584 Se\n0.417347 0.059278 0.738416 Se\n0.059277 0.417347 0.738416 Se\n0.940723 0.582653 0.261584 Se\n","nsites":13,"nelements":4,"elements":["Na","Eu","Ge","Se"],"chemical_system":"Eu-Ge-Na-Se","density":4.863703011169314,"density_atomic":0.03838637291362678,"volume":338.661848287967,"volume_molar":15.688225541783869,"formula_full":"Na3 Eu2 Ge2 Se6","formula_reduced":"Na3Eu2(GeSe3)2","formula_anonymous":"A2B2C3D6","energy_above_hull":0.9361160846153844,"spacegroup":12},{"id":"jvasp-116750","created_at":"2022-09-04T14:38:44.347156Z","updated_at":"2022-09-04T14:38:44.347178Z","structure_string":"Sr2 Al1 Tl1 Co2 O7\n1.0\n3.682193 0.065387 -0.264096\n-0.112015 3.681661 0.255976\n0.181497 -0.144245 12.114540\nSr Al Tl Co O\n2 1 1 2 7\ndirect\n0.464398 0.535868 0.796568 Sr\n0.544015 0.455794 0.217981 Sr\n0.446678 0.553180 0.511497 Al\n0.003650 0.996415 0.004529 Tl\n0.935380 0.064859 0.629997 Co\n0.062638 0.937061 0.368670 Co\n0.428054 0.079952 0.592431 O\n0.920353 0.572244 0.592377 O\n0.574835 0.883523 0.394314 O\n0.116183 0.424824 0.394329 O\n0.963181 0.037077 0.792689 O\n0.040155 0.959661 0.202393 O\n0.500490 0.499552 0.002230 O\n","nsites":13,"nelements":5,"elements":["Sr","Al","Tl","Co","O"],"chemical_system":"Al-Co-O-Sr-Tl","density":6.419651331308228,"density_atomic":0.07896411737047129,"volume":164.63173949008595,"volume_molar":7.62642699056114,"formula_full":"Sr2 Al1 Tl1 Co2 O7","formula_reduced":"Sr2AlTlCo2O7","formula_anonymous":"ABC2D2E7","energy_above_hull":2.059514947692308,"spacegroup":8},{"id":"jvasp-119370","created_at":"2022-09-04T14:38:50.849778Z","updated_at":"2022-09-04T14:38:50.849795Z","structure_string":"Li6 Fe1 O5 F1\n1.0\n4.851018 0.072286 2.462453\n1.641138 4.595434 2.560919\n0.062437 0.023195 5.507949\nLi Fe O F\n6 1 5 1\ndirect\n0.697950 0.468582 0.057573 Li\n0.510341 0.084408 0.747200 Li\n0.915229 0.306630 0.509301 Li\n0.076841 0.707923 0.473258 Li\n0.516932 0.916965 0.268979 Li\n0.261191 0.487367 0.926265 Li\n0.034169 0.987248 0.961490 Fe\n0.356705 0.807757 0.089567 O\n0.920421 0.666598 0.209074 O\n0.208105 0.888689 0.646965 O\n0.102192 0.340355 0.789372 O\n0.657216 0.210940 0.917975 O\n0.777713 0.126905 0.385410 F\n","nsites":13,"nelements":4,"elements":["Li","Fe","O","F"],"chemical_system":"F-Fe-Li-O","density":2.6910624318006096,"density_atomic":0.1072224003793413,"volume":121.24332186191879,"volume_molar":5.616495003557386,"formula_full":"Li6 Fe1 O5 F1","formula_reduced":"Li6FeO5F","formula_anonymous":"ABC5D6","energy_above_hull":1.6835448678846154,"spacegroup":1},{"id":"jvasp-112065","created_at":"2022-09-04T14:38:44.120785Z","updated_at":"2022-09-04T14:38:44.120814Z","structure_string":"Zn1 H4 C4 O4\n1.0\n4.034112 0.081353 -0.015545\n0.685990 4.746549 0.112427\n-0.076956 0.141706 6.756257\nZn H C O\n1 4 4 4\ndirect\n0.101517 0.626775 0.714418 Zn\n0.045747 0.106436 0.142364 H\n0.639186 0.092161 0.225813 H\n0.969363 0.626194 0.211500 H\n0.563556 0.608220 0.300904 H\n0.984819 0.125304 0.456524 C\n0.856540 0.201088 0.245722 C\n0.754769 0.516658 0.196668 C\n0.600952 0.575993 0.991013 C\n0.138093 0.868380 0.484459 O\n0.927981 0.297615 0.592883 O\n0.693396 0.762894 0.872595 O\n0.364318 0.442179 0.943437 O\n","nsites":13,"nelements":4,"elements":["Zn","H","C","O"],"chemical_system":"C-H-O-Zn","density":2.337540766970893,"density_atomic":0.10083746101547028,"volume":128.9203423914607,"volume_molar":5.972126528529011,"formula_full":"Zn1 H4 C4 O4","formula_reduced":"ZnH4(CO)4","formula_anonymous":"AB4C4D4","energy_above_hull":3.9589926461538463,"spacegroup":1},{"id":"jvasp-116713","created_at":"2022-09-04T14:38:45.038964Z","updated_at":"2022-09-04T14:38:45.038991Z","structure_string":"Al5 O8\n1.0\n4.877100 -0.000000 2.815795\n1.625700 4.598174 2.815795\n-0.000000 -0.000000 5.631590\nAl O\n5 8\ndirect\n0.616402 0.127866 0.127866 Al\n0.127866 0.616401 0.127867 Al\n0.127866 0.127866 0.616402 Al\n0.127866 0.127866 0.127866 Al\n0.750000 0.749999 0.750002 Al\n0.350520 0.883159 0.883161 O\n0.883160 0.350519 0.883161 O\n0.883160 0.883159 0.350522 O\n0.883160 0.883159 0.883162 O\n0.914026 0.361991 0.361992 O\n0.361991 0.914025 0.361992 O\n0.361991 0.361991 0.914026 O\n0.361991 0.361991 0.361992 O\n","nsites":13,"nelements":2,"elements":["Al","O"],"chemical_system":"Al-O","density":3.4567372658366606,"density_atomic":0.1029355196563765,"volume":126.29265430822251,"volume_molar":5.850401086139511,"formula_full":"Al5 O8","formula_reduced":"Al5O8","formula_anonymous":"A5B8","energy_above_hull":2.388517076923077,"spacegroup":216},{"id":"jvasp-112036","created_at":"2022-09-04T14:38:43.706136Z","updated_at":"2022-09-04T14:38:43.706161Z","structure_string":"H3 C6 S2 N1 O1\n1.0\n3.727682 0.028704 0.030479\n0.354214 5.288701 1.636983\n0.051932 0.022215 7.520348\nH C S N O\n3 6 2 1 1\ndirect\n0.765834 0.820538 0.675195 H\n0.783062 0.823007 0.330852 H\n0.257066 0.216738 0.006301 H\n0.891626 0.668515 0.628708 C\n0.901689 0.668270 0.443225 C\n0.076983 0.450741 0.417065 C\n0.062949 0.449394 0.748792 C\n0.001259 0.512923 0.061462 C\n0.152137 0.366872 0.255414 C\n0.744261 0.781010 0.011365 S\n0.234532 0.241954 0.629830 S\n0.109478 0.383433 0.939227 N\n0.346193 0.167601 0.269451 O\n","nsites":13,"nelements":5,"elements":["H","C","S","N","O"],"chemical_system":"C-H-N-O-S","density":1.898120409434712,"density_atomic":0.08781238026643812,"volume":148.04290648489115,"volume_molar":6.857963241319471,"formula_full":"H3 C6 S2 N1 O1","formula_reduced":"H3C6S2NO","formula_anonymous":"ABC2D3E6","energy_above_hull":5.222041288461538,"spacegroup":1}]}