{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=4556","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_reduced&page=4554","results":[{"id":"jvasp-119666","created_at":"2022-09-04T14:38:50.354520Z","updated_at":"2022-09-04T14:38:50.354529Z","structure_string":"Al2 Cu2 Sn2 S8\n1.0\n6.331062 0.008301 -3.560649\n-2.093230 5.893746 -3.693614\n0.007673 -0.008301 7.263643\nAl Cu Sn S\n2 2 2 8\ndirect\n-0.000000 0.000000 0.500000 Al\n0.000000 0.500000 0.000001 Al\n0.384153 0.634153 0.750000 Cu\n0.615847 0.365847 0.250000 Cu\n0.000000 0.000000 0.000000 Sn\n0.500000 -0.000000 0.500000 Sn\n0.239251 0.737158 0.997905 S\n0.239251 0.241347 0.502095 S\n0.227913 0.749973 0.477941 S\n0.772032 0.749973 0.022060 S\n0.760748 0.262843 0.002095 S\n0.760748 0.758654 0.497906 S\n0.772087 0.250028 0.522059 S\n0.227968 0.250028 0.977940 S\n","nsites":14,"nelements":4,"elements":["Al","Cu","Sn","S"],"chemical_system":"Al-Cu-S-Sn","density":4.13501924739044,"density_atomic":0.05164828059338619,"volume":271.06420270247617,"volume_molar":11.659905597653456,"formula_full":"Al2 Cu2 Sn2 S8","formula_reduced":"AlCuSnS4","formula_anonymous":"ABCD4","energy_above_hull":1.4037935642857144,"spacegroup":74},{"id":"jvasp-8369","created_at":"2022-09-04T14:36:41.869745Z","updated_at":"2022-09-04T14:36:41.869773Z","structure_string":"Al2 Cu2 Se4\n1.0\n5.129606 0.000000 -2.346006\n-1.072938 5.016141 -2.346006\n0.028432 0.035156 6.843182\nAl Cu Se\n2 2 4\ndirect\n0.750000 0.250000 0.499999 Al\n0.500000 0.500000 -0.000001 Al\n0.250000 0.750000 0.499999 Cu\n0.000000 0.000000 0.000000 Cu\n0.378542 0.375000 0.249999 Se\n0.125000 0.621459 0.749999 Se\n0.625000 0.128542 0.750000 Se\n0.871458 0.875000 0.249999 Se\n","nsites":8,"nelements":3,"elements":["Al","Cu","Se"],"chemical_system":"Al-Cu-Se","density":4.663585840621506,"density_atomic":0.045216419605569214,"volume":176.9268789918664,"volume_molar":13.318482118956329,"formula_full":"Al2 Cu2 Se4","formula_reduced":"AlCuSe2","formula_anonymous":"ABC2","energy_above_hull":0.8396624958333334,"spacegroup":122},{"id":"jvasp-79642","created_at":"2022-09-04T14:37:17.984738Z","updated_at":"2022-09-04T14:37:17.984762Z","structure_string":"Al1 Cu1 Se2\n1.0\n-3.288601 -3.288601 -0.000000\n-3.288601 0.000000 -3.288601\n0.000000 -3.288601 -3.288601\nAl Cu Se\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 Se\n0.750000 0.750000 0.750000 Se\n","nsites":4,"nelements":3,"elements":["Al","Cu","Se"],"chemical_system":"Al-Cu-Se","density":5.799896542234399,"density_atomic":0.05623367183214773,"volume":71.13175913427149,"volume_molar":10.709136650324965,"formula_full":"Al1 Cu1 Se2","formula_reduced":"AlCuSe2","formula_anonymous":"ABC2","energy_above_hull":1.0392524958333331,"spacegroup":225},{"id":"jvasp-114300","created_at":"2022-09-04T14:38:40.803752Z","updated_at":"2022-09-04T14:38:40.803780Z","structure_string":"Al1 Cu1 Se2\n1.0\n3.736295 0.000000 0.000000\n-1.868147 3.235726 -0.000000\n0.000000 -0.000000 6.574620\nAl Cu Se\n1 1 2\ndirect\n0.000000 0.000000 0.011748 Al\n0.333333 0.666667 0.566401 Cu\n0.666666 0.333333 0.768632 Se\n0.333333 0.666667 0.210418 Se\n","nsites":4,"nelements":3,"elements":["Al","Cu","Se"],"chemical_system":"Al-Cu-Se","density":5.190392995280535,"density_atomic":0.05032414875870177,"volume":79.4847026460302,"volume_molar":11.96670169002846,"formula_full":"Al1 Cu1 Se2","formula_reduced":"AlCuSe2","formula_anonymous":"ABC2","energy_above_hull":0.8709799958333333,"spacegroup":156},{"id":"jvasp-2724","created_at":"2022-09-04T14:37:01.107843Z","updated_at":"2022-09-04T14:37:01.107860Z","structure_string":"Al2 Cu2 Se4\n1.0\n5.129615 0.000000 -2.346010\n-1.072939 5.016150 -2.346010\n0.028429 0.035153 6.843190\nAl Cu Se\n2 2 4\ndirect\n0.750001 0.250000 0.500000 Al\n0.500000 0.500000 0.000000 Al\n0.250000 0.750000 0.500000 Cu\n0.000000 0.000000 0.000000 Cu\n0.378542 0.375000 0.250000 Se\n0.125000 0.621458 0.750000 Se\n0.625001 0.128541 0.750000 Se\n0.871459 0.875000 0.250000 Se\n","nsites":8,"nelements":3,"elements":["Al","Cu","Se"],"chemical_system":"Al-Cu-Se","density":4.663565949782412,"density_atomic":0.045216226751281216,"volume":176.9276336127122,"volume_molar":13.318538924368255,"formula_full":"Al2 Cu2 Se4","formula_reduced":"AlCuSe2","formula_anonymous":"ABC2","energy_above_hull":0.8396624958333334,"spacegroup":122},{"id":"jvasp-2397","created_at":"2022-09-04T14:37:01.415589Z","updated_at":"2022-09-04T14:37:01.415607Z","structure_string":"Al2 Cu2 S4\n1.0\n4.852601 0.000000 -2.207014\n-1.003773 4.747649 -2.207014\n0.016943 0.020900 6.475510\nAl Cu S\n2 2 4\ndirect\n0.500000 0.500000 0.000001 Al\n0.750000 0.250000 0.500001 Al\n0.250000 0.750000 0.500001 Cu\n0.000000 0.000000 0.000000 Cu\n0.866695 0.875000 0.250001 S\n0.624999 0.133305 0.750000 S\n0.383305 0.375000 0.250001 S\n0.125000 0.616695 0.750001 S\n","nsites":8,"nelements":3,"elements":["Al","Cu","S"],"chemical_system":"Al-Cu-S","density":3.4325887450973496,"density_atomic":0.053464015497558526,"volume":149.63335480039515,"volume_molar":11.263914062487517,"formula_full":"Al2 Cu2 S4","formula_reduced":"AlCuS2","formula_anonymous":"ABC2","energy_above_hull":1.0272183125,"spacegroup":122},{"id":"jvasp-8370","created_at":"2022-09-04T14:37:17.018495Z","updated_at":"2022-09-04T14:37:17.018510Z","structure_string":"Al2 Cu2 S4\n1.0\n4.852714 -0.000000 -2.207066\n-1.003796 4.747760 -2.207066\n0.016952 0.020911 6.475679\nAl Cu S\n2 2 4\ndirect\n0.499999 0.500000 -0.000001 Al\n0.749999 0.250000 0.499999 Al\n0.249999 0.750000 0.499999 Cu\n0.000000 0.000000 0.000000 Cu\n0.866688 0.875000 0.249998 S\n0.624999 0.133311 0.749999 S\n0.383310 0.375000 0.249999 S\n0.124999 0.616689 0.749999 S\n","nsites":8,"nelements":3,"elements":["Al","Cu","S"],"chemical_system":"Al-Cu-S","density":3.4323338274269575,"density_atomic":0.05346004504747186,"volume":149.6444679927991,"volume_molar":11.264750627599385,"formula_full":"Al2 Cu2 S4","formula_reduced":"AlCuS2","formula_anonymous":"ABC2","energy_above_hull":1.0271433124999998,"spacegroup":122},{"id":"jvasp-79640","created_at":"2022-09-04T14:37:17.947084Z","updated_at":"2022-09-04T14:37:17.947104Z","structure_string":"Al1 Cu1 S2\n1.0\n-3.113389 -3.113389 0.000000\n-3.113389 -0.000000 -3.113389\n0.000000 -3.113389 -3.113389\nAl Cu S\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 S\n0.750000 0.750000 0.750000 S\n","nsites":4,"nelements":3,"elements":["Al","Cu","S"],"chemical_system":"Al-Cu-S","density":4.254906644755476,"density_atomic":0.06627196314174827,"volume":60.35734887533737,"volume_molar":9.087011270692734,"formula_full":"Al1 Cu1 S2","formula_reduced":"AlCuS2","formula_anonymous":"ABC2","energy_above_hull":1.2595458125,"spacegroup":225},{"id":"jvasp-79757","created_at":"2022-09-04T14:37:11.628054Z","updated_at":"2022-09-04T14:37:11.628079Z","structure_string":"Al1 Cu1 S2\n1.0\n-1.796380 3.111421 -0.000000\n-3.592759 -0.000000 0.000000\n-1.796380 1.037140 6.033725\nAl Cu S\n1 1 2\ndirect\n0.002150 0.002150 0.993552 Al\n0.857488 0.857489 0.427535 Cu\n0.733596 0.733596 0.799213 S\n0.253766 0.253766 0.238702 S\n","nsites":4,"nelements":3,"elements":["Al","Cu","S"],"chemical_system":"Al-Cu-S","density":3.8075692829120937,"density_atomic":0.059304495314327764,"volume":67.44851260935718,"volume_molar":10.154610924654596,"formula_full":"Al1 Cu1 S2","formula_reduced":"AlCuS2","formula_anonymous":"ABC2","energy_above_hull":1.0566433125,"spacegroup":160},{"id":"jvasp-106486","created_at":"2022-09-04T14:36:52.747015Z","updated_at":"2022-09-04T14:36:52.747035Z","structure_string":"Al1 Cu1 Rh2\n1.0\n3.654210 -0.000000 2.109759\n1.218070 3.445223 2.109759\n0.000000 -0.000000 4.219519\nAl Cu Rh\n1 1 2\ndirect\n0.500000 0.500000 0.500000 Al\n0.000000 0.000000 0.000000 Cu\n0.250000 0.250000 0.250000 Rh\n0.750000 0.749999 0.750001 Rh\n","nsites":4,"nelements":3,"elements":["Al","Cu","Rh"],"chemical_system":"Al-Cu-Rh","density":9.263251295848335,"density_atomic":0.07529847920783267,"volume":53.12192280749162,"volume_molar":7.997692414714224,"formula_full":"Al1 Cu1 Rh2","formula_reduced":"AlCuRh2","formula_anonymous":"ABC2","energy_above_hull":1.6276323125000005,"spacegroup":225},{"id":"jvasp-77385","created_at":"2022-09-04T14:38:04.681500Z","updated_at":"2022-09-04T14:38:04.681521Z","structure_string":"Al1 Cu1 Rh2\n1.0\n-8.139973 -0.000000 -4.699616\n-8.425226 0.057926 5.193688\n-5.549040 8.193010 0.211987\nAl Cu Rh\n1 1 2\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 -0.000000 0.000000 Cu\n0.757729 -0.000000 0.000000 Rh\n0.242272 -0.000000 0.000000 Rh\n","nsites":4,"nelements":3,"elements":["Al","Cu","Rh"],"chemical_system":"Al-Cu-Rh","density":0.7353657347654633,"density_atomic":0.005977590342842883,"volume":669.1659633031392,"volume_molar":100.74529057031246,"formula_full":"Al1 Cu1 Rh2","formula_reduced":"AlCuRh2","formula_anonymous":"ABC2","energy_above_hull":2.4009673125,"spacegroup":71},{"id":"jvasp-59484","created_at":"2022-09-04T14:37:41.481047Z","updated_at":"2022-09-04T14:37:41.481063Z","structure_string":"Al2 Cu4 Re4\n1.0\n5.919257 0.000000 0.000000\n0.000000 5.919257 0.000000\n0.000000 -0.000000 3.927740\nAl Cu Re\n2 4 4\ndirect\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.000000 Al\n0.863514 0.363514 0.000000 Cu\n0.363514 0.136486 0.000000 Cu\n0.636487 0.863514 0.000000 Cu\n0.136486 0.636487 0.000000 Cu\n0.663434 0.163433 0.500000 Re\n0.163433 0.336567 0.500000 Re\n0.836567 0.663434 0.500000 Re\n0.336567 0.836567 0.500000 Re\n","nsites":10,"nelements":3,"elements":["Al","Cu","Re"],"chemical_system":"Al-Cu-Re","density":12.705450398874232,"density_atomic":0.07266459805594,"volume":137.61859650419612,"volume_molar":8.28758559341913,"formula_full":"Al2 Cu4 Re4","formula_reduced":"Al(CuRe)2","formula_anonymous":"AB2C2","energy_above_hull":3.21090994,"spacegroup":127}]}