{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3587","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=nsites&page=3585","results":[{"id":"jvasp-9883","created_at":"2022-09-04T14:38:14.051795Z","updated_at":"2022-09-04T14:38:14.051826Z","structure_string":"Ca2 Cu4 O8\n1.0\n4.872265 -0.000000 -2.558002\n-1.342983 4.683521 -2.558002\n0.667146 0.885335 7.189866\nCa Cu O\n2 4 8\ndirect\n0.375001 0.624999 0.750001 Ca\n0.625001 0.375000 0.250001 Ca\n0.000000 -0.000001 0.500000 Cu\n0.000000 0.500000 0.000000 Cu\n0.500001 -0.000001 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.760801 0.787726 0.521602 O\n0.766128 0.239199 0.978399 O\n0.212274 0.239199 0.978399 O\n0.239200 0.212273 0.478399 O\n0.239201 0.766126 0.478399 O\n0.233873 0.760800 0.021602 O\n0.760801 0.233872 0.521602 O\n0.787728 0.760800 0.021602 O\n","nsites":14,"nelements":3,"elements":["Ca","Cu","O"],"chemical_system":"Ca-Cu-O","density":4.124532149903815,"density_atomic":0.07521365117393136,"volume":186.13642312916093,"volume_molar":8.006712433190906,"formula_full":"Ca2 Cu4 O8","formula_reduced":"Ca(CuO2)2","formula_anonymous":"AB2C4","energy_above_hull":1.1687393314285712,"spacegroup":141},{"id":"jvasp-22411","created_at":"2022-09-04T14:38:30.537449Z","updated_at":"2022-09-04T14:38:30.537474Z","structure_string":"Ho2 Cu4 O8\n1.0\n5.063689 0.105223 -2.510216\n-1.362948 4.859609 -2.545226\n-0.052979 -0.025373 6.256472\nHo Cu O\n2 4 8\ndirect\n0.874998 0.124998 0.749994 Ho\n0.125002 0.875003 0.250004 Ho\n0.500000 -0.000000 -0.000000 Cu\n0.500000 0.500000 -0.000001 Cu\n-0.000000 0.500000 0.500000 Cu\n0.500000 0.500000 0.499999 Cu\n0.721586 0.529961 0.855203 O\n0.133616 0.825244 0.855203 O\n0.278413 0.470039 0.144795 O\n0.866383 0.174756 0.144795 O\n0.529991 0.133625 0.355198 O\n0.825208 0.721574 0.355197 O\n0.174792 0.278426 0.644801 O\n0.470008 0.866375 0.644800 O\n","nsites":14,"nelements":3,"elements":["Ho","Cu","O"],"chemical_system":"Cu-Ho-O","density":7.687321501654416,"density_atomic":0.09102269478751361,"volume":153.80779521724844,"volume_molar":6.616087091310892,"formula_full":"Ho2 Cu4 O8","formula_reduced":"Ho(CuO2)2","formula_anonymous":"AB2C4","energy_above_hull":1.391801495238095,"spacegroup":88},{"id":"jvasp-51658","created_at":"2022-09-04T14:38:28.847890Z","updated_at":"2022-09-04T14:38:28.847913Z","structure_string":"Ni6 Bi4 S4\n1.0\n6.576314 -0.000000 -2.325078\n-3.288158 5.695255 -2.325078\n-0.000000 -0.000000 6.975235\nNi Bi S\n6 4 4\ndirect\n0.520650 0.270651 0.250000 Ni\n0.979349 0.229350 0.749999 Ni\n0.750000 0.979350 0.229349 Ni\n0.229349 0.750001 0.979349 Ni\n0.250000 0.520651 0.270650 Ni\n0.270650 0.250000 0.520650 Ni\n0.005674 0.005674 0.005674 Bi\n0.494326 0.500000 -0.000000 Bi\n0.000000 0.494326 0.500000 Bi\n0.500000 0.000000 0.494326 Bi\n0.000000 0.959954 0.500000 S\n0.959953 0.500000 -0.000000 S\n0.500000 0.000000 0.959952 S\n0.540046 0.540047 0.540046 S\n","nsites":14,"nelements":3,"elements":["Ni","Bi","S"],"chemical_system":"Bi-Ni-S","density":8.366874921636457,"density_atomic":0.053588731441790736,"volume":261.2489533402579,"volume_molar":11.237699788697896,"formula_full":"Ni6 Bi4 S4","formula_reduced":"Ni3(BiS)2","formula_anonymous":"A2B2C3","energy_above_hull":1.369463685714286,"spacegroup":199},{"id":"jvasp-44421","created_at":"2022-09-04T14:38:17.089972Z","updated_at":"2022-09-04T14:38:17.089997Z","structure_string":"Li2 Fe1 Si3 O8\n1.0\n5.061715 0.059029 -0.100887\n1.790591 5.890627 0.023285\n1.638704 1.074214 5.787475\nLi Fe Si O\n2 1 3 8\ndirect\n0.248312 0.645917 0.147467 Li\n0.777112 0.327868 0.862999 Li\n0.658556 0.301662 0.361755 Fe\n0.297578 0.120327 0.179373 Si\n0.331231 0.746430 0.609761 Si\n0.728469 0.880263 0.811393 Si\n0.983616 0.186776 0.123369 O\n0.063168 0.752083 0.840368 O\n0.438421 0.337736 0.107763 O\n0.340146 0.561985 0.462451 O\n0.712412 0.139198 0.668382 O\n0.286515 0.010294 0.457604 O\n0.506269 0.892892 0.059450 O\n0.628181 0.695171 0.709261 O\n","nsites":14,"nelements":4,"elements":["Li","Fe","Si","O"],"chemical_system":"Fe-Li-O-Si","density":2.712732746733051,"density_atomic":0.0811091115429171,"volume":172.6069948700179,"volume_molar":7.424740137627469,"formula_full":"Li2 Fe1 Si3 O8","formula_reduced":"Li2FeSi3O8","formula_anonymous":"AB2C3D8","energy_above_hull":2.781405664285714,"spacegroup":1},{"id":"jvasp-9880","created_at":"2022-09-04T14:38:10.724719Z","updated_at":"2022-09-04T14:38:10.724735Z","structure_string":"Ca2 Ag4 O8\n1.0\n5.298538 -0.000000 -2.781800\n-1.460480 5.093281 -2.781800\n0.464216 0.616036 7.321205\nCa Ag O\n2 4 8\ndirect\n0.375001 0.625000 0.750001 Ca\n0.625000 0.375000 0.250000 Ca\n0.000000 0.000000 0.500001 Ag\n-0.000000 0.500000 -0.000000 Ag\n0.500001 0.000000 0.500001 Ag\n0.000000 0.000000 0.000000 Ag\n0.754353 0.777677 0.508704 O\n0.768977 0.245648 0.991298 O\n0.222324 0.245648 0.991298 O\n0.245648 0.222323 0.491297 O\n0.245648 0.768976 0.491297 O\n0.231025 0.754352 0.008704 O\n0.754353 0.231025 0.508704 O\n0.777677 0.754352 0.008704 O\n","nsites":14,"nelements":3,"elements":["Ca","Ag","O"],"chemical_system":"Ag-Ca-O","density":4.92321885699158,"density_atomic":0.06489381846689556,"volume":215.73703521764332,"volume_molar":9.279991380183752,"formula_full":"Ca2 Ag4 O8","formula_reduced":"Ca(AgO2)2","formula_anonymous":"AB2C4","energy_above_hull":1.27204842,"spacegroup":141},{"id":"jvasp-45915","created_at":"2022-09-04T14:38:06.546708Z","updated_at":"2022-09-04T14:38:06.546729Z","structure_string":"Li2 Ni2 P2 O8\n1.0\n4.811418 0.000001 0.000000\n0.000000 -2.777873 7.747471\n2.405710 -4.166810 0.000000\nLi Ni P O\n2 2 2 8\ndirect\n0.006157 0.018471 0.987686 Li\n0.569347 0.708040 0.861307 Li\n0.449302 0.347903 0.101397 Ni\n0.126206 0.378618 0.747587 Ni\n0.863781 0.591341 0.272440 P\n0.711724 0.135168 0.576555 P\n0.158743 0.522494 0.018799 O\n0.034216 0.204020 0.549028 O\n0.541294 0.522494 0.299964 O\n0.416756 0.204020 0.830196 O\n0.753050 0.204020 0.212737 O\n0.928097 0.784288 0.143808 O\n0.647408 0.942221 0.705186 O\n0.822457 0.522494 0.636249 O\n","nsites":14,"nelements":4,"elements":["Li","Ni","P","O"],"chemical_system":"Li-Ni-O-P","density":3.4340247239902135,"density_atomic":0.09013453818571647,"volume":155.32336751039753,"volume_molar":6.681279874748747,"formula_full":"Li2 Ni2 P2 O8","formula_reduced":"LiNiPO4","formula_anonymous":"ABCD4","energy_above_hull":2.0662717,"spacegroup":148},{"id":"jvasp-52262","created_at":"2022-09-04T14:38:14.742122Z","updated_at":"2022-09-04T14:38:14.742146Z","structure_string":"Li2 Ag4 F8\n1.0\n5.491113 -0.030380 -0.000000\n-1.317934 5.330693 0.000000\n-0.000000 -0.000000 6.750825\nLi Ag F\n2 4 8\ndirect\n0.000000 0.000000 0.000000 Li\n0.500000 0.500000 0.500000 Li\n0.001910 0.501910 0.250000 Ag\n0.498090 0.998089 0.750001 Ag\n0.501910 0.001910 0.250000 Ag\n0.998090 0.498090 0.750001 Ag\n0.213999 0.786001 0.000000 F\n0.286002 0.713998 0.500000 F\n0.241205 0.241205 0.768159 F\n0.258795 0.258795 0.268158 F\n0.741205 0.741204 0.731842 F\n0.758795 0.758795 0.231842 F\n0.713999 0.286001 0.500000 F\n0.786001 0.213999 0.000000 F\n","nsites":14,"nelements":3,"elements":["Li","Ag","F"],"chemical_system":"Ag-F-Li","density":5.026500381083182,"density_atomic":0.07094496645734125,"volume":197.33605777963277,"volume_molar":8.488467978374583,"formula_full":"Li2 Ag4 F8","formula_reduced":"LiAg2F4","formula_anonymous":"AB2C4","energy_above_hull":0.0433350645714284,"spacegroup":64},{"id":"jvasp-10745","created_at":"2022-09-04T14:38:28.479407Z","updated_at":"2022-09-04T14:38:28.479430Z","structure_string":"Ca2 V4 O8\n1.0\n5.381404 -0.000000 -2.825306\n-1.483321 5.172937 -2.825306\n-0.138036 -0.183181 6.274756\nCa V O\n2 4 8\ndirect\n0.374999 0.625000 0.750000 Ca\n0.624999 0.375000 0.249999 Ca\n-0.000000 0.000000 0.500000 V\n0.000000 0.500000 -0.000000 V\n0.499999 0.000000 0.500000 V\n0.000000 0.000000 0.000000 V\n0.775538 0.804156 0.551078 O\n0.753076 0.224461 0.948921 O\n0.195844 0.224461 0.948921 O\n0.224461 0.195845 0.448921 O\n0.224461 0.753078 0.448921 O\n0.246923 0.775539 0.051079 O\n0.775538 0.246923 0.551078 O\n0.804155 0.775539 0.051078 O\n","nsites":14,"nelements":3,"elements":["Ca","V","O"],"chemical_system":"Ca-O-V","density":4.044867031467998,"density_atomic":0.08278911897430381,"volume":169.10434817340354,"volume_molar":7.274072770202035,"formula_full":"Ca2 V4 O8","formula_reduced":"CaV2O4","formula_anonymous":"AB2C4","energy_above_hull":2.5443146885714283,"spacegroup":141},{"id":"jvasp-9901","created_at":"2022-09-04T14:38:11.447778Z","updated_at":"2022-09-04T14:38:11.447811Z","structure_string":"Zn2 Cu4 O8\n1.0\n5.897667 0.064346 0.005295\n-0.346525 5.887880 -0.005867\n-2.779575 -2.971965 4.270300\nZn Cu O\n2 4 8\ndirect\n0.875027 0.624989 0.750001 Zn\n0.124979 0.375014 0.250004 Zn\n0.500003 0.000003 0.000004 Cu\n-0.000002 -0.000000 0.499999 Cu\n0.500001 -0.000005 0.500000 Cu\n0.500001 0.499998 -0.000001 Cu\n0.718744 0.175480 0.938181 O\n0.324473 0.262715 0.043234 O\n0.219478 0.781252 0.456773 O\n0.762717 0.719430 0.438195 O\n0.780517 0.218748 0.543226 O\n0.675525 0.737283 0.956764 O\n0.237276 0.280572 0.561805 O\n0.281257 0.824522 0.061820 O\n","nsites":14,"nelements":3,"elements":["Zn","Cu","O"],"chemical_system":"Cu-O-Zn","density":5.741376772137575,"density_atomic":0.09435827471560781,"volume":148.37066534117392,"volume_molar":6.38220736671002,"formula_full":"Zn2 Cu4 O8","formula_reduced":"Zn(CuO2)2","formula_anonymous":"AB2C4","energy_above_hull":1.0577664714285713,"spacegroup":88},{"id":"jvasp-40202","created_at":"2022-09-04T14:38:29.971120Z","updated_at":"2022-09-04T14:38:29.971155Z","structure_string":"Ca4 Sn2 S8\n1.0\n0.000000 6.784634 -0.014485\n6.878693 0.000000 0.000000\n0.000000 -2.251303 -7.379244\nCa Sn S\n4 2 8\ndirect\n0.713809 0.250000 0.056433 Ca\n0.286190 0.750000 0.943566 Ca\n0.722656 0.250000 0.552916 Ca\n0.277343 0.750000 0.447083 Ca\n0.241913 0.250000 0.187110 Sn\n0.758086 0.750000 0.812889 Sn\n0.035088 0.250000 0.880853 S\n0.964912 0.750000 0.119145 S\n0.042223 0.250000 0.392026 S\n0.957777 0.750000 0.607973 S\n0.498882 0.507149 0.251571 S\n0.501117 0.007149 0.748428 S\n0.501117 0.492850 0.748428 S\n0.498882 0.992850 0.251571 S\n","nsites":14,"nelements":3,"elements":["Ca","Sn","S"],"chemical_system":"Ca-S-Sn","density":3.1525874952641533,"density_atomic":0.04062571597146128,"volume":344.609311250901,"volume_molar":14.823469853996981,"formula_full":"Ca4 Sn2 S8","formula_reduced":"Ca2SnS4","formula_anonymous":"AB2C4","energy_above_hull":0.9595660771428572,"spacegroup":11},{"id":"jvasp-44666","created_at":"2022-09-04T14:38:10.664916Z","updated_at":"2022-09-04T14:38:10.664937Z","structure_string":"Li1 Mn3 Fe2 O8\n1.0\n-0.011682 4.074254 4.074254\n4.074254 -0.011682 4.074254\n4.074254 4.074254 -0.011682\nLi Mn Fe O\n1 3 2 8\ndirect\n0.124481 0.124481 0.124481 Li\n0.498753 0.498753 0.003954 Mn\n0.003954 0.498753 0.498753 Mn\n0.498753 0.003954 0.498753 Mn\n0.499166 0.499166 0.499166 Fe\n0.875954 0.875954 0.875954 Fe\n0.711956 0.261748 0.261748 O\n0.262020 0.262020 0.262020 O\n0.261748 0.711956 0.261748 O\n0.261748 0.261748 0.711956 O\n0.739230 0.739230 0.283063 O\n0.739230 0.283063 0.739230 O\n0.283063 0.739230 0.739230 O\n0.739941 0.739941 0.739941 O\n","nsites":14,"nelements":4,"elements":["Li","Mn","Fe","O"],"chemical_system":"Fe-Li-Mn-O","density":5.029418949793117,"density_atomic":0.10305994042607734,"volume":135.84327666133183,"volume_molar":5.84333809538688,"formula_full":"Li1 Mn3 Fe2 O8","formula_reduced":"LiMn3(FeO4)2","formula_anonymous":"AB2C3D8","energy_above_hull":3.367415051724138,"spacegroup":160},{"id":"jvasp-45906","created_at":"2022-09-04T14:38:10.662294Z","updated_at":"2022-09-04T14:38:10.662317Z","structure_string":"Li2 Mn2 Co2 O8\n1.0\n-2.861885 1.606229 4.654204\n-2.861885 4.923436 -0.037035\n-2.861885 -1.606229 -4.654204\nLi Mn Co O\n2 2 2 8\ndirect\n0.749999 0.125318 0.624681 Li\n0.249998 0.874683 0.375317 Li\n0.499998 0.500001 -0.000001 Mn\n-0.000001 0.500000 0.499999 Mn\n0.499999 0.000000 -0.000000 Co\n-0.000001 0.500001 -0.000000 Co\n0.527864 0.737805 0.790060 O\n0.972131 0.737806 0.234327 O\n0.973263 0.286427 0.240308 O\n0.526733 0.732957 0.240308 O\n0.473264 0.267045 0.759690 O\n0.026733 0.713574 0.759690 O\n0.027866 0.262196 0.765670 O\n0.472133 0.262196 0.209937 O\n","nsites":14,"nelements":4,"elements":["Li","Mn","Co","O"],"chemical_system":"Co-Li-Mn-O","density":4.667478508516097,"density_atomic":0.1064648332988691,"volume":131.49882046683965,"volume_molar":5.656460047323408,"formula_full":"Li2 Mn2 Co2 O8","formula_reduced":"LiMnCoO4","formula_anonymous":"ABCD4","energy_above_hull":2.653248877339901,"spacegroup":74}]}