{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=501","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-id&page=499","results":[{"id":"jvasp-87060","created_at":"2022-09-04T14:35:49.837406Z","updated_at":"2022-09-04T14:35:49.837424Z","structure_string":"Li3 La1 P2\n1.0\n4.225491 -0.000000 0.000000\n-2.112745 3.659383 0.000000\n-0.000000 0.000000 6.879779\nLi La P\n3 1 2\ndirect\n0.000000 0.000000 0.500000 Li\n0.666666 0.333333 0.361222 Li\n0.333332 0.666667 0.638778 Li\n0.000000 0.000000 0.000000 La\n0.333332 0.666667 0.263192 P\n0.666666 0.333333 0.736808 P\n","nsites":6,"nelements":3,"elements":["Li","La","P"],"chemical_system":"La-Li-P","density":3.460255974794381,"density_atomic":0.056401637841878335,"volume":106.37988947804965,"volume_molar":10.677244474500965,"formula_full":"Li3 La1 P2","formula_reduced":"Li3LaP2","formula_anonymous":"AB2C3","energy_above_hull":1.6503893333333337,"spacegroup":164},{"id":"jvasp-8706","created_at":"2022-09-04T14:36:46.648896Z","updated_at":"2022-09-04T14:36:46.648921Z","structure_string":"Y2 Au2 O4\n1.0\n1.783894 -3.089796 -0.000000\n1.783894 3.089796 0.000000\n-0.000000 0.000000 12.108005\nY Au O\n2 2 4\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.000000 0.500000 Y\n0.333332 0.666666 0.250000 Au\n0.666666 0.333332 0.750000 Au\n0.333332 0.666666 0.082375 O\n0.666666 0.333332 0.582375 O\n0.666666 0.333332 0.917625 O\n0.333332 0.666666 0.417625 O\n","nsites":8,"nelements":3,"elements":["Y","Au","O"],"chemical_system":"Au-O-Y","density":7.909132692897011,"density_atomic":0.059936109387246576,"volume":133.47546381951628,"volume_molar":10.047600389092679,"formula_full":"Y2 Au2 O4","formula_reduced":"YAuO2","formula_anonymous":"ABC2","energy_above_hull":1.4248175049999998,"spacegroup":194},{"id":"jvasp-87059","created_at":"2022-09-04T14:35:41.705545Z","updated_at":"2022-09-04T14:35:41.705560Z","structure_string":"Li3 La1 Sb2\n1.0\n4.620464 0.000000 -0.000000\n-2.310232 4.001439 0.000000\n0.000000 0.000000 7.441591\nLi La Sb\n3 1 2\ndirect\n0.000000 0.000000 0.500000 Li\n0.666667 0.333333 0.356479 Li\n0.333333 0.666667 0.643521 Li\n0.000000 0.000000 0.000000 La\n0.333333 0.666667 0.259271 Sb\n0.666667 0.333333 0.740729 Sb\n","nsites":6,"nelements":3,"elements":["Li","La","Sb"],"chemical_system":"La-Li-Sb","density":4.866920333197503,"density_atomic":0.043609756522101806,"volume":137.58389127807095,"volume_molar":13.809159326417992,"formula_full":"Li3 La1 Sb2","formula_reduced":"Li3LaSb2","formula_anonymous":"AB2C3","energy_above_hull":1.1742712000000002,"spacegroup":164},{"id":"jvasp-87053","created_at":"2022-09-04T14:36:18.975382Z","updated_at":"2022-09-04T14:36:18.975406Z","structure_string":"Sc6 Si6 Ni2\n1.0\n3.937590 0.000000 0.649417\n1.936007 4.906128 0.523508\n0.005558 -0.004539 12.228347\nSc Si Ni\n6 6 2\ndirect\n0.600330 0.720306 0.079034 Sc\n0.473902 0.673126 0.379072 Sc\n0.742278 0.741883 0.773563 Sc\n0.526099 0.326874 0.620928 Sc\n0.399670 0.279694 0.920967 Sc\n0.257723 0.258117 0.226437 Sc\n0.962832 0.838114 0.236224 Si\n0.866543 0.721027 0.545888 Si\n0.133458 0.278974 0.454113 Si\n0.119436 0.836813 0.924317 Si\n0.037169 0.161886 0.763777 Si\n0.880564 0.163187 0.075683 Si\n0.243707 0.915171 0.597419 Ni\n0.756294 0.084829 0.402582 Ni\n","nsites":14,"nelements":3,"elements":["Sc","Si","Ni"],"chemical_system":"Ni-Sc-Si","density":3.9059585409294173,"density_atomic":0.059267520730868814,"volume":236.21706842729898,"volume_molar":10.160945971312474,"formula_full":"Sc6 Si6 Ni2","formula_reduced":"Sc3Si3Ni","formula_anonymous":"AB3C3","energy_above_hull":2.85343485,"spacegroup":12},{"id":"jvasp-87051","created_at":"2022-09-04T14:36:11.728687Z","updated_at":"2022-09-04T14:36:11.728714Z","structure_string":"U2 Te6\n1.0\n4.172748 0.000000 0.000000\n0.000000 6.023683 -0.850208\n0.000000 -0.023250 10.336961\nU Te\n2 6\ndirect\n0.250000 0.288852 0.663068 U\n0.750000 0.711148 0.336932 U\n0.250000 0.910906 0.162140 Te\n0.750000 0.089094 0.837860 Te\n0.750000 0.235071 0.438751 Te\n0.250000 0.764929 0.561249 Te\n0.750000 0.575530 0.833730 Te\n0.250000 0.424470 0.166270 Te\n","nsites":8,"nelements":2,"elements":["U","Te"],"chemical_system":"Te-U","density":7.9380124496203575,"density_atomic":0.030800001464343012,"volume":259.7402473912722,"volume_molar":19.552404135343302,"formula_full":"U2 Te6","formula_reduced":"UTe3","formula_anonymous":"AB3","energy_above_hull":2.035234825,"spacegroup":11},{"id":"jvasp-87050","created_at":"2022-09-04T14:36:04.644593Z","updated_at":"2022-09-04T14:36:04.644614Z","structure_string":"Ba2 Zr1 O4\n1.0\n4.041386 -0.000000 -1.194712\n-0.353180 4.025925 -1.194712\n-0.003398 -0.003709 7.421315\nBa Zr O\n2 1 4\ndirect\n0.647234 0.647233 0.294468 Ba\n0.352766 0.352766 0.705531 Ba\n0.000000 0.000000 0.000000 Zr\n0.843029 0.843028 0.686058 O\n0.156971 0.156971 0.313942 O\n-0.000000 0.499999 0.000000 O\n0.500000 0.000000 0.000000 O\n","nsites":7,"nelements":3,"elements":["Ba","Zr","O"],"chemical_system":"Ba-O-Zr","density":5.913489864331218,"density_atomic":0.05798958547705388,"volume":120.71133018824314,"volume_molar":10.384866024577677,"formula_full":"Ba2 Zr1 O4","formula_reduced":"Ba2ZrO4","formula_anonymous":"AB2C4","energy_above_hull":1.7159900628571427,"spacegroup":139},{"id":"jvasp-8705","created_at":"2022-09-04T14:37:04.864419Z","updated_at":"2022-09-04T14:37:04.864449Z","structure_string":"Mg2 H2 O3\n1.0\n1.538489 -2.664741 0.000000\n1.538489 2.664741 -0.000000\n0.000000 -0.000000 7.384250\nMg H O\n2 2 3\ndirect\n0.333334 0.666667 0.165365 Mg\n0.666667 0.333334 0.834635 Mg\n0.333334 0.666667 0.559763 H\n0.666667 0.333334 0.440237 H\n0.333334 0.666667 0.691292 O\n0.666667 0.333334 0.308708 O\n0.000000 0.000000 0.000000 O\n","nsites":7,"nelements":3,"elements":["Mg","H","O"],"chemical_system":"H-Mg-O","density":2.7048692430975176,"density_atomic":0.11561448611201192,"volume":60.54604604840021,"volume_molar":5.20881159664154,"formula_full":"Mg2 H2 O3","formula_reduced":"Mg2H2O3","formula_anonymous":"A2B2C3","energy_above_hull":1.431244085714286,"spacegroup":164},{"id":"jvasp-87047","created_at":"2022-09-04T14:35:59.897665Z","updated_at":"2022-09-04T14:35:59.897695Z","structure_string":"Ca3 Ni7 B2\n1.0\n4.838024 0.001198 5.994746\n2.118101 4.349728 5.994746\n0.001914 0.001198 7.703470\nCa Ni B\n3 7 2\ndirect\n0.644561 0.644563 0.644564 Ca\n0.355437 0.355438 0.355438 Ca\n0.499999 0.500001 0.500001 Ca\n0.061832 0.571693 0.061833 Ni\n0.061832 0.061833 0.571693 Ni\n0.571692 0.061833 0.061833 Ni\n0.428306 0.938169 0.938169 Ni\n0.938166 0.938169 0.428309 Ni\n0.938165 0.428309 0.938169 Ni\n0.000000 0.000000 0.000000 Ni\n0.830956 0.830959 0.830959 B\n0.169042 0.169043 0.169043 B\n","nsites":12,"nelements":3,"elements":["Ca","Ni","B"],"chemical_system":"B-Ca-Ni","density":5.664586036490145,"density_atomic":0.0740633174313092,"volume":162.02352819436592,"volume_molar":8.131070776819168,"formula_full":"Ca3 Ni7 B2","formula_reduced":"Ca3Ni7B2","formula_anonymous":"A2B3C7","energy_above_hull":1.4821444355555558,"spacegroup":166},{"id":"jvasp-87046","created_at":"2022-09-04T14:35:52.915222Z","updated_at":"2022-09-04T14:35:52.915248Z","structure_string":"Ca2 Ni8 B2\n1.0\n5.036259 0.000000 -0.000000\n-2.518130 4.361528 0.000000\n0.000000 0.000000 6.861298\nCa Ni B\n2 8 2\ndirect\n0.000000 0.000000 0.500000 Ca\n0.000000 0.000000 0.000000 Ca\n0.500000 0.500000 0.794468 Ni\n0.000000 0.500000 0.794468 Ni\n0.333333 0.666667 0.500000 Ni\n0.666667 0.333333 0.500000 Ni\n0.500000 0.000000 0.794468 Ni\n0.000000 0.500000 0.205532 Ni\n0.500000 0.500000 0.205532 Ni\n0.500000 0.000000 0.205532 Ni\n0.666667 0.333333 0.000000 B\n0.333333 0.666667 0.000000 B\n","nsites":12,"nelements":3,"elements":["Ca","Ni","B"],"chemical_system":"B-Ca-Ni","density":6.294764318608547,"density_atomic":0.07962111271994236,"volume":150.7137942446063,"volume_molar":7.563497361789142,"formula_full":"Ca2 Ni8 B2","formula_reduced":"CaNi4B","formula_anonymous":"ABC4","energy_above_hull":1.455020433888889,"spacegroup":191},{"id":"jvasp-87043","created_at":"2022-09-04T14:38:17.534175Z","updated_at":"2022-09-04T14:38:17.534205Z","structure_string":"Sm2 Cu2 P4\n1.0\n3.727630 -0.000000 -0.722505\n-0.140039 3.724999 -0.722505\n0.058494 0.060734 10.279050\nSm Cu P\n2 2 4\ndirect\n0.883906 0.883907 0.767814 Sm\n0.116092 0.116092 0.232185 Sm\n0.749999 0.250000 0.499999 Cu\n0.249999 0.750000 0.499999 Cu\n0.674629 0.674630 0.349259 P\n0.325369 0.325369 0.650740 P\n0.500000 0.000000 -0.000000 P\n-0.000000 0.500000 -0.000000 P\n","nsites":8,"nelements":3,"elements":["Sm","Cu","P"],"chemical_system":"Cu-P-Sm","density":6.404001201292226,"density_atomic":0.055922137394508534,"volume":143.05604851193667,"volume_molar":10.76879575885339,"formula_full":"Sm2 Cu2 P4","formula_reduced":"SmCuP2","formula_anonymous":"ABC2","energy_above_hull":1.5396850812500005,"spacegroup":139},{"id":"jvasp-87042","created_at":"2022-09-04T14:35:53.397961Z","updated_at":"2022-09-04T14:35:53.397986Z","structure_string":"K2 N6\n1.0\n-3.052367 -3.052367 3.475211\n-3.052367 3.052367 -3.475211\n3.052367 -3.052367 -3.475211\nK N\n2 6\ndirect\n0.000000 0.750000 0.750000 K\n0.000000 0.250000 0.250000 K\n0.500001 -0.000000 0.500001 N\n0.500001 0.500001 0.000000 N\n0.225148 0.862574 0.362574 N\n0.774853 0.137426 0.637427 N\n0.500001 0.637426 0.862574 N\n0.500001 0.362574 0.137426 N\n","nsites":8,"nelements":2,"elements":["K","N"],"chemical_system":"K-N","density":2.080098018273108,"density_atomic":0.061769675264633644,"volume":129.51338930836855,"volume_molar":9.74934825899593,"formula_full":"K2 N6","formula_reduced":"KN3","formula_anonymous":"AB3","energy_above_hull":3.5728844375000004,"spacegroup":140},{"id":"jvasp-87040","created_at":"2022-09-04T14:35:47.256153Z","updated_at":"2022-09-04T14:35:47.256181Z","structure_string":"V2 P8\n1.0\n4.782519 -0.016382 2.287103\n1.889190 5.505504 0.903451\n0.008852 -0.008190 6.125363\nV P\n2 8\ndirect\n0.062385 0.250000 0.875229 V\n0.937614 0.750000 0.124770 V\n0.497260 0.310428 0.555143 P\n0.947596 0.189572 0.555143 P\n0.185767 0.323524 0.178240 P\n0.635994 0.176476 0.178240 P\n0.814232 0.676476 0.821759 P\n0.364006 0.823524 0.821759 P\n0.052404 0.810427 0.444856 P\n0.502740 0.689572 0.444856 P\n","nsites":10,"nelements":2,"elements":["V","P"],"chemical_system":"P-V","density":3.598452450238688,"density_atomic":0.06197327569345827,"volume":161.35987468959257,"volume_molar":9.717318783966878,"formula_full":"V2 P8","formula_reduced":"VP4","formula_anonymous":"AB4","energy_above_hull":3.39064324,"spacegroup":15}]}