{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density&page=510","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=density&page=508","results":[{"id":"jvasp-20972","created_at":"2022-09-04T14:38:20.098826Z","updated_at":"2022-09-04T14:38:20.098847Z","structure_string":"Na6 Sc2 F12\n1.0\n0.000000 5.580506 -0.011609\n5.838205 0.000000 0.000000\n0.000000 -5.450045 -8.096378\nNa Sc F\n6 2 12\ndirect\n0.723275 0.559848 0.741917 Na\n0.276725 0.059849 0.758084 Na\n0.276725 0.440151 0.258084 Na\n0.723275 0.940151 0.241917 Na\n0.500000 0.500000 0.000000 Na\n0.500000 0.000000 0.500000 Na\n-0.000000 0.500000 0.500000 Sc\n0.000000 0.000000 0.000000 Sc\n0.896531 0.566357 0.268009 F\n0.103469 0.066358 0.231991 F\n0.353915 0.179099 0.056194 F\n0.646085 0.679098 0.443806 F\n0.646085 0.820900 0.943806 F\n0.249000 0.712485 0.078600 F\n0.751000 0.287514 0.921401 F\n0.249000 0.787513 0.578600 F\n0.896531 0.933642 0.768010 F\n0.751001 0.212486 0.421400 F\n0.353915 0.320901 0.556195 F\n0.103469 0.433642 0.731991 F\n","nsites":20,"nelements":3,"elements":["Na","Sc","F"],"chemical_system":"F-Na-Sc","density":2.8655091077509054,"density_atomic":0.07571441466056159,"volume":264.1504935310248,"volume_molar":7.953757269336503,"formula_full":"Na6 Sc2 F12","formula_reduced":"Na3ScF6","formula_anonymous":"AB3C6","energy_above_hull":0.0,"spacegroup":14},{"id":"jvasp-109010","created_at":"2022-09-04T14:38:17.627303Z","updated_at":"2022-09-04T14:38:17.627313Z","structure_string":"Li3 Sb1 S3\n1.0\n5.711698 -0.004151 -2.683010\n-4.223403 3.845307 -2.683010\n-0.001609 -0.004152 6.310471\nLi Sb S\n3 1 3\ndirect\n0.549149 0.982878 0.549149 Li\n0.549149 0.549149 0.982877 Li\n0.982878 0.549149 0.549149 Li\n0.140334 0.140334 0.140334 Sb\n0.977385 0.623649 0.977384 S\n0.977385 0.977385 0.623648 S\n0.623649 0.977385 0.977384 S\n","nsites":7,"nelements":3,"elements":["Li","Sb","S"],"chemical_system":"Li-S-Sb","density":2.8657054456909554,"density_atomic":0.05059250476856892,"volume":138.36041587624294,"volume_molar":11.903227143126768,"formula_full":"Li3 Sb1 S3","formula_reduced":"Li3SbS3","formula_anonymous":"AB3C3","energy_above_hull":1.3760680142857145,"spacegroup":160},{"id":"jvasp-116303","created_at":"2022-09-04T14:38:41.813693Z","updated_at":"2022-09-04T14:38:41.813724Z","structure_string":"Li2 Se1\n1.0\n4.062742 -0.712340 -0.970092\n1.642197 -3.877741 0.470275\n-0.651923 1.568482 -3.882351\nLi Se\n2 1\ndirect\n0.113735 0.534339 0.194674 Li\n0.613878 0.534165 0.694568 Li\n0.863785 0.034265 0.944619 Se\n","nsites":3,"nelements":2,"elements":["Li","Se"],"chemical_system":"Li-Se","density":2.8657163258769245,"density_atomic":0.055764892285683564,"volume":53.79728852753806,"volume_molar":10.799161467305579,"formula_full":"Li2 Se1","formula_reduced":"Li2Se","formula_anonymous":"AB2","energy_above_hull":0.3560744555555556,"spacegroup":225},{"id":"jvasp-43039","created_at":"2022-09-04T14:38:05.272309Z","updated_at":"2022-09-04T14:38:05.272334Z","structure_string":"Li6 Cr2 Si2 C2 O14\n1.0\n0.000000 4.964905 0.016574\n6.376795 0.000000 0.000000\n0.000000 -0.717016 -8.234738\nLi Cr Si C O\n6 2 2 2 14\ndirect\n0.219352 0.749999 0.109002 Li\n0.756628 0.971322 0.287360 Li\n0.756628 0.528677 0.287360 Li\n0.243371 0.471323 0.712641 Li\n0.243371 0.028677 0.712641 Li\n0.780647 0.250000 0.890999 Li\n0.197227 0.250000 0.320997 Cr\n0.802771 0.749999 0.679004 Cr\n0.718423 0.250000 0.579259 Si\n0.281575 0.749999 0.420741 Si\n0.306515 0.250000 0.032927 C\n0.693483 0.749999 0.967074 C\n0.510959 0.749999 0.843830 O\n0.824548 0.054849 0.698975 O\n0.824548 0.445150 0.698975 O\n0.383717 0.250000 0.545043 O\n0.157464 0.749999 0.596606 O\n0.842534 0.250000 0.403395 O\n0.628690 0.749999 0.113658 O\n0.175450 0.554849 0.301026 O\n0.175450 0.945150 0.301026 O\n0.489040 0.250000 0.156171 O\n0.057166 0.250000 0.070085 O\n0.942833 0.749999 0.929916 O\n0.616281 0.749999 0.454958 O\n0.371308 0.250000 0.886343 O\n","nsites":26,"nelements":5,"elements":["Li","Cr","Si","C","O"],"chemical_system":"C-Cr-Li-O-Si","density":2.8658473342191315,"density_atomic":0.09975540052977966,"volume":260.6375179881946,"volume_molar":6.036907002545922,"formula_full":"Li6 Cr2 Si2 C2 O14","formula_reduced":"Li3CrSiCO7","formula_anonymous":"ABCD3E7","energy_above_hull":2.9369861923076925,"spacegroup":11},{"id":"jvasp-31799","created_at":"2022-09-04T14:37:04.066617Z","updated_at":"2022-09-04T14:37:04.066644Z","structure_string":"Ru1 F6\n1.0\n-3.146520 -3.146520 3.146520\n-3.146520 3.146520 -3.146520\n3.146520 -3.146520 -3.146520\nRu F\n1 6\ndirect\n0.000000 0.000000 0.000000 Ru\n0.706636 0.706636 0.000000 F\n0.293364 0.293364 0.000000 F\n0.706636 0.000000 0.706636 F\n0.293364 0.000000 0.293364 F\n0.000000 0.706636 0.706636 F\n0.000000 0.293364 0.293364 F\n","nsites":7,"nelements":2,"elements":["Ru","F"],"chemical_system":"F-Ru","density":2.8658806780796686,"density_atomic":0.05617544985938066,"volume":124.60959400454325,"volume_molar":10.720235930597308,"formula_full":"Ru1 F6","formula_reduced":"RuF6","formula_anonymous":"AB6","energy_above_hull":0.3599774564285714,"spacegroup":229},{"id":"jvasp-22558","created_at":"2022-09-04T14:37:40.794425Z","updated_at":"2022-09-04T14:37:40.794452Z","structure_string":"K1 Al1 F4\n1.0\n3.643963 -0.000000 0.000000\n-0.000000 3.643963 0.000000\n-0.000000 0.000000 6.198982\nK Al F\n1 1 4\ndirect\n0.000000 0.000000 0.000000 K\n0.500000 0.500000 0.500000 Al\n0.500000 0.500000 0.788888 F\n0.500000 0.500000 0.211112 F\n0.500000 0.000000 0.500000 F\n0.000000 0.500000 0.500000 F\n","nsites":6,"nelements":3,"elements":["K","Al","F"],"chemical_system":"Al-F-K","density":2.866115817542314,"density_atomic":0.07289251886366306,"volume":82.3129738625482,"volume_molar":8.261671916241104,"formula_full":"K1 Al1 F4","formula_reduced":"KAlF4","formula_anonymous":"ABC4","energy_above_hull":0.0022416666666666,"spacegroup":123},{"id":"jvasp-52362","created_at":"2022-09-04T14:36:16.654830Z","updated_at":"2022-09-04T14:36:16.654865Z","structure_string":"Li4 Cr2 S6\n1.0\n3.037501 5.268770 -0.005084\n-3.037501 5.268770 0.005084\n-2.045985 0.000000 5.870658\nLi Cr S\n4 2 6\ndirect\n0.842641 0.842642 0.500000 Li\n0.157358 0.157359 0.500000 Li\n0.500000 0.500000 0.500000 Li\n0.000000 0.000000 0.000000 Li\n0.331858 0.331858 -0.000000 Cr\n0.668142 0.668142 0.000000 Cr\n0.280637 0.719363 0.769782 S\n0.436965 0.922623 0.229809 S\n0.077377 0.563035 0.229809 S\n0.563035 0.077378 0.770191 S\n0.922622 0.436965 0.770191 S\n0.719363 0.280637 0.230218 S\n","nsites":12,"nelements":3,"elements":["Li","Cr","S"],"chemical_system":"Cr-Li-S","density":2.8661636962761605,"density_atomic":0.06389872678245224,"volume":187.7971691181712,"volume_molar":9.424508222992936,"formula_full":"Li4 Cr2 S6","formula_reduced":"Li2CrS3","formula_anonymous":"AB2C3","energy_above_hull":2.017924566666668,"spacegroup":12},{"id":"jvasp-44612","created_at":"2022-09-04T14:38:30.019903Z","updated_at":"2022-09-04T14:38:30.019932Z","structure_string":"Li6 Fe2 Si2 C2 O14\n1.0\n0.000000 4.941210 0.025707\n6.359260 0.000000 0.000000\n0.000000 -0.512360 -8.437657\nLi Fe Si C O\n6 2 2 2 14\ndirect\n0.234246 0.750000 0.112055 Li\n0.758554 0.984669 0.265062 Li\n0.758554 0.515331 0.265062 Li\n0.241446 0.484669 0.734938 Li\n0.241446 0.015331 0.734938 Li\n0.765754 0.250000 0.887945 Li\n0.208667 0.250000 0.346791 Fe\n0.791333 0.750000 0.653209 Fe\n0.718225 0.250000 0.580719 Si\n0.281775 0.750000 0.419281 Si\n0.281644 0.250000 0.033899 C\n0.718356 0.750000 0.966101 C\n0.538604 0.750000 0.845896 O\n0.823899 0.052440 0.693772 O\n0.823899 0.447560 0.693772 O\n0.380879 0.250000 0.558993 O\n0.175823 0.750000 0.598466 O\n0.824177 0.250000 0.401534 O\n0.636558 0.750000 0.109044 O\n0.176101 0.552440 0.306228 O\n0.176101 0.947560 0.306228 O\n0.461396 0.250000 0.154104 O\n0.029041 0.250000 0.061401 O\n0.970959 0.750000 0.938599 O\n0.619121 0.750000 0.441007 O\n0.363442 0.250000 0.890956 O\n","nsites":26,"nelements":5,"elements":["Li","Fe","Si","C","O"],"chemical_system":"C-Fe-Li-O-Si","density":2.866385796021004,"density_atomic":0.09809543785928033,"volume":265.0480039377312,"volume_molar":6.13906303026943,"formula_full":"Li6 Fe2 Si2 C2 O14","formula_reduced":"Li3FeSiCO7","formula_anonymous":"ABCD3E7","energy_above_hull":2.820703738461538,"spacegroup":11},{"id":"jvasp-38169","created_at":"2022-09-04T14:37:40.065828Z","updated_at":"2022-09-04T14:37:40.065850Z","structure_string":"K3 Tl1\n1.0\n-0.000000 4.533475 4.533475\n4.533475 0.000000 4.533475\n4.533475 4.533475 0.000000\nK Tl\n3 1\ndirect\n0.000000 0.000000 0.000000 K\n0.499998 0.499998 0.499998 K\n0.250000 0.250000 0.250000 K\n0.749999 0.749999 0.749999 Tl\n","nsites":4,"nelements":2,"elements":["K","Tl"],"chemical_system":"K-Tl","density":2.866467725785523,"density_atomic":0.021465268252114037,"volume":186.34754306441312,"volume_molar":28.05527836535144,"formula_full":"K3 Tl1","formula_reduced":"K3Tl","formula_anonymous":"AB3","energy_above_hull":0.0068774999999999,"spacegroup":225},{"id":"jvasp-44061","created_at":"2022-09-04T14:36:54.502149Z","updated_at":"2022-09-04T14:36:54.502171Z","structure_string":"Li4 Fe2 B2 P2 O14\n1.0\n0.000000 5.003185 0.030136\n6.092286 0.000000 0.000000\n0.000000 -0.580953 -8.498809\nLi Fe B P O\n4 2 2 2 14\ndirect\n0.766742 0.483552 0.204222 Li\n0.766742 0.016448 0.204222 Li\n0.233259 0.983553 0.795778 Li\n0.233259 0.516448 0.795778 Li\n0.209893 0.250000 0.329823 Fe\n0.790108 0.750001 0.670177 Fe\n0.266942 0.250000 0.056291 B\n0.733060 0.750001 0.943709 B\n0.276710 0.750001 0.428579 P\n0.723291 0.250000 0.571420 P\n0.530110 0.750001 0.817075 O\n0.813817 0.053928 0.678017 O\n0.813817 0.446072 0.678017 O\n0.139268 0.750001 0.584137 O\n0.415835 0.250000 0.532285 O\n0.584166 0.750001 0.467715 O\n0.022418 0.250000 0.129577 O\n0.186185 0.553928 0.321983 O\n0.186185 0.946073 0.321983 O\n0.469892 0.250000 0.182925 O\n0.977583 0.750001 0.870423 O\n0.698584 0.750001 0.095247 O\n0.860733 0.250000 0.415863 O\n0.301418 0.250000 0.904752 O\n","nsites":24,"nelements":5,"elements":["Li","Fe","B","P","O"],"chemical_system":"B-Fe-Li-O-P","density":2.8665878338854904,"density_atomic":0.09268408793718207,"volume":258.9441244355378,"volume_molar":6.497491526357351,"formula_full":"Li4 Fe2 B2 P2 O14","formula_reduced":"Li2FeBPO7","formula_anonymous":"ABCD2E7","energy_above_hull":2.788052340277778,"spacegroup":11},{"id":"jvasp-33661","created_at":"2022-09-04T14:36:51.182153Z","updated_at":"2022-09-04T14:36:51.182179Z","structure_string":"Mo2 P2 H6 O14\n1.0\n6.277772 0.000000 -2.342311\n0.000000 6.367170 0.000000\n-0.049444 0.000000 7.030673\nMo P H O\n2 2 6 14\ndirect\n0.281928 0.250000 0.163310 Mo\n0.718072 0.750000 0.836690 Mo\n0.659261 0.250000 0.667993 P\n0.340739 0.750000 0.332007 P\n0.002369 0.250000 0.701012 H\n0.997631 0.750000 0.298987 H\n0.748481 0.250000 0.305192 H\n0.251520 0.750000 0.694808 H\n0.665074 0.250000 0.061335 H\n0.334926 0.750000 0.938665 H\n0.379236 0.750000 0.820019 O\n0.620764 0.250000 0.179981 O\n0.785487 0.750000 0.097667 O\n0.214513 0.250000 0.902333 O\n0.145831 0.750000 0.408580 O\n0.854169 0.250000 0.591420 O\n0.325414 0.560277 0.190830 O\n0.457446 0.250000 0.482289 O\n0.674586 0.439723 0.809169 O\n0.325414 0.939723 0.190830 O\n0.043399 0.250000 0.197021 O\n0.674586 0.060277 0.809169 O\n0.542554 0.750000 0.517711 O\n0.956601 0.750000 0.802979 O\n","nsites":24,"nelements":4,"elements":["Mo","P","H","O"],"chemical_system":"H-Mo-O-P","density":2.866599834703292,"density_atomic":0.08562555974921249,"volume":280.290138485439,"volume_molar":7.033111114996696,"formula_full":"Mo2 P2 H6 O14","formula_reduced":"MoPH3O7","formula_anonymous":"ABC3D7","energy_above_hull":3.2676254916666663,"spacegroup":11},{"id":"jvasp-104529","created_at":"2022-09-04T14:36:45.540492Z","updated_at":"2022-09-04T14:36:45.540517Z","structure_string":"Na2 Li1 Bi1 Cl6\n1.0\n6.320812 -0.000000 3.649322\n2.106937 5.959319 3.649322\n-0.000000 -0.000000 7.298645\nNa Li Bi Cl\n2 1 1 6\ndirect\n0.750000 0.750000 0.749999 Na\n0.250000 0.250000 0.250000 Na\n0.500000 0.500000 0.499999 Li\n0.000000 0.000000 0.000000 Bi\n0.740012 0.259988 0.259987 Cl\n0.259988 0.259988 0.740012 Cl\n0.259988 0.740013 0.740011 Cl\n0.259988 0.740013 0.259987 Cl\n0.740012 0.259988 0.740012 Cl\n0.740012 0.740013 0.259987 Cl\n","nsites":10,"nelements":4,"elements":["Na","Li","Bi","Cl"],"chemical_system":"Bi-Cl-Li-Na","density":2.866701104795867,"density_atomic":0.03637376466323152,"volume":274.9234260623156,"volume_molar":16.55627569968717,"formula_full":"Na2 Li1 Bi1 Cl6","formula_reduced":"Na2LiBiCl6","formula_anonymous":"ABC2D6","energy_above_hull":0.0,"spacegroup":225}]}