{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-created_at&page=79","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-created_at&page=77","results":[{"id":"jvasp-118221","created_at":"2022-09-04T14:38:53.441993Z","updated_at":"2022-09-04T14:38:53.442020Z","structure_string":"Cu1 S1 O2\n1.0\n3.295599 -0.000000 0.000000\n0.000000 3.295599 -0.000000\n-0.000000 0.000000 4.263614\nCu S O\n1 1 2\ndirect\n0.500001 0.500001 0.550998 Cu\n0.000000 0.000000 0.041633 S\n0.000000 0.000000 0.404699 O\n0.500001 0.500001 0.012668 O\n","nsites":4,"nelements":3,"elements":["Cu","S","O"],"chemical_system":"Cu-O-S","density":4.5760053240574985,"density_atomic":0.08638003723697366,"volume":46.30699555067871,"volume_molar":6.971681134472022,"formula_full":"Cu1 S1 O2","formula_reduced":"CuSO2","formula_anonymous":"ABC2","energy_above_hull":1.5144793625,"spacegroup":99},{"id":"jvasp-122939","created_at":"2022-09-04T14:38:53.441742Z","updated_at":"2022-09-04T14:38:53.441771Z","structure_string":"Dy1 V1\n1.0\n3.455115 0.000000 0.000000\n0.000000 3.455115 0.000000\n-0.000000 -0.000000 3.455115\nDy V\n1 1\ndirect\n0.000000 0.000000 0.000000 Dy\n0.500001 0.500001 0.500001 V\n","nsites":2,"nelements":2,"elements":["Dy","V"],"chemical_system":"Dy-V","density":8.592913515294468,"density_atomic":0.04848891592824507,"volume":41.24653978570365,"volume_molar":12.419623422622383,"formula_full":"Dy1 V1","formula_reduced":"DyV","formula_anonymous":"AB","energy_above_hull":null,"spacegroup":221},{"id":"jvasp-123419","created_at":"2022-09-04T14:38:53.438241Z","updated_at":"2022-09-04T14:38:53.438266Z","structure_string":"Zr1 Os1\n1.0\n1.557969 -2.698479 0.000000\n1.557969 2.698479 0.000000\n0.000000 0.000000 4.307242\nZr Os\n1 1\ndirect\n0.333334 0.666667 0.750000 Zr\n0.666667 0.333334 0.250000 Os\n","nsites":2,"nelements":2,"elements":["Zr","Os"],"chemical_system":"Os-Zr","density":12.904744170920308,"density_atomic":0.05522336573360333,"volume":36.21655387047522,"volume_molar":10.905059262506228,"formula_full":"Zr1 Os1","formula_reduced":"ZrOs","formula_anonymous":"AB","energy_above_hull":3.40766975,"spacegroup":187},{"id":"jvasp-121199","created_at":"2022-09-04T14:38:53.436797Z","updated_at":"2022-09-04T14:38:53.436818Z","structure_string":"Li2 Te1\n1.0\n9.099602 -0.000000 -0.000000\n0.000000 9.099602 0.000000\n-0.000000 0.000000 11.500869\nLi Te\n2 1\ndirect\n0.000000 0.000000 0.207646 Li\n0.000000 0.000000 0.792354 Li\n0.000000 0.000000 0.000000 Te\n","nsites":3,"nelements":2,"elements":["Li","Te"],"chemical_system":"Li-Te","density":0.24670323035752756,"density_atomic":0.0031502556784746244,"volume":952.3036560170954,"volume_molar":191.16355542658562,"formula_full":"Li2 Te1","formula_reduced":"Li2Te","formula_anonymous":"AB2","energy_above_hull":0.7500625888888892,"spacegroup":123},{"id":"jvasp-118686","created_at":"2022-09-04T14:38:53.435980Z","updated_at":"2022-09-04T14:38:53.436006Z","structure_string":"Mg2 Cl1\n1.0\n3.334323 0.000000 0.000000\n0.000000 3.349352 0.000000\n0.000000 0.000000 7.164038\nMg Cl\n2 1\ndirect\n-0.033309 0.000000 0.705996 Mg\n-0.033309 0.000000 0.294004 Mg\n0.466618 0.000000 0.000000 Cl\n","nsites":3,"nelements":2,"elements":["Mg","Cl"],"chemical_system":"Cl-Mg","density":1.7447276400422087,"density_atomic":0.037496861067869765,"volume":80.00669694911167,"volume_molar":16.0603863590071,"formula_full":"Mg2 Cl1","formula_reduced":"Mg2Cl","formula_anonymous":"AB2","energy_above_hull":0.02851,"spacegroup":47},{"id":"jvasp-120284","created_at":"2022-09-04T14:38:53.433707Z","updated_at":"2022-09-04T14:38:53.433741Z","structure_string":"Li2 F2\n1.0\n2.795511 0.432801 -0.280907\n-1.039136 -2.646135 -0.028144\n0.778346 1.271546 -4.692655\nLi F\n2 2\ndirect\n0.080770 0.056789 0.171260 Li\n0.580805 0.556780 0.671273 Li\n0.330813 0.806846 0.421296 F\n0.830799 0.306825 0.921286 F\n","nsites":4,"nelements":2,"elements":["Li","F"],"chemical_system":"F-Li","density":2.6518394759711073,"density_atomic":0.1231312106883126,"volume":32.48567099795172,"volume_molar":4.890832085817874,"formula_full":"Li2 F2","formula_reduced":"LiF","formula_anonymous":"AB","energy_above_hull":0.0,"spacegroup":225},{"id":"jvasp-121997","created_at":"2022-09-04T14:38:53.430335Z","updated_at":"2022-09-04T14:38:53.430352Z","structure_string":"K4 Ca1 W3 O12\n1.0\n6.636020 -0.000000 -2.346187\n-3.318010 5.746962 -2.346187\n-0.000000 -0.000000 7.038562\nK Ca W O\n4 1 3 12\ndirect\n-0.000000 0.500000 -0.000000 K\n0.500000 0.000000 -0.000000 K\n0.000000 0.000000 0.500000 K\n0.500000 0.500000 0.499999 K\n0.000000 0.000000 0.000000 Ca\n0.500000 0.000000 0.500000 W\n-0.000000 0.500000 0.500000 W\n0.500000 0.500000 -0.000000 W\n-0.000000 0.273593 0.273593 O\n0.273593 0.273593 -0.000000 O\n0.273593 0.000000 0.273593 O\n0.726407 0.726407 -0.000001 O\n0.750000 0.250000 0.499999 O\n0.750000 0.500000 0.249999 O\n0.500000 0.750000 0.249999 O\n0.250000 0.500000 0.749999 O\n-0.000000 0.726407 0.726407 O\n0.250000 0.750000 0.499999 O\n0.500000 0.250000 0.749999 O\n0.726407 0.000000 0.726407 O\n","nsites":20,"nelements":4,"elements":["K","Ca","W","O"],"chemical_system":"Ca-K-O-W","density":5.814864599022179,"density_atomic":0.07450750891026649,"volume":268.42932064856853,"volume_molar":8.082595765284271,"formula_full":"K4 Ca1 W3 O12","formula_reduced":"K4Ca(WO4)3","formula_anonymous":"AB3C4D12","energy_above_hull":2.9441107210000004,"spacegroup":229},{"id":"jvasp-121230","created_at":"2022-09-04T14:38:53.426563Z","updated_at":"2022-09-04T14:38:53.426590Z","structure_string":"Mg2 Zn1\n1.0\n4.964974 0.000000 1.135879\n0.000000 3.099070 0.000000\n1.678890 0.000000 4.761544\nMg Zn\n2 1\ndirect\n0.132040 0.000000 -0.203128 Mg\n-0.198742 0.000000 0.469787 Mg\n0.466701 0.000000 0.133341 Zn\n","nsites":3,"nelements":2,"elements":["Mg","Zn"],"chemical_system":"Mg-Zn","density":2.810973490387379,"density_atomic":0.044540150424730834,"volume":67.35495887176563,"volume_molar":13.520701440326114,"formula_full":"Mg2 Zn1","formula_reduced":"Mg2Zn","formula_anonymous":"AB2","energy_above_hull":null,"spacegroup":65},{"id":"jvasp-120045","created_at":"2022-09-04T14:38:53.426473Z","updated_at":"2022-09-04T14:38:53.426503Z","structure_string":"H1 C1 Cl1\n1.0\n2.389814 0.000000 0.000000\n0.000000 2.389814 0.000000\n0.000000 0.000000 7.081110\nH C Cl\n1 1 1\ndirect\n0.000000 0.000000 0.059236 H\n0.000000 0.000000 0.216599 C\n0.000000 0.000000 0.681468 Cl\n","nsites":3,"nelements":3,"elements":["H","C","Cl"],"chemical_system":"C-Cl-H","density":1.990248331884433,"density_atomic":0.07418083402648562,"volume":40.441713002699274,"volume_molar":8.118189609259243,"formula_full":"H1 C1 Cl1","formula_reduced":"HCCl","formula_anonymous":"ABC","energy_above_hull":3.1072946891666664,"spacegroup":99},{"id":"jvasp-120250","created_at":"2022-09-04T14:38:53.426070Z","updated_at":"2022-09-04T14:38:53.426094Z","structure_string":"Hf1 Si1 Te1\n1.0\n2.940911 -0.000000 -0.000000\n0.000000 2.940911 0.000000\n0.000000 0.000000 9.064551\nHf Si Te\n1 1 1\ndirect\n-0.000000 0.000000 0.349338 Hf\n-0.000000 0.000000 0.645697 Si\n-0.000000 0.000000 0.021959 Te\n","nsites":3,"nelements":3,"elements":["Hf","Si","Te"],"chemical_system":"Hf-Si-Te","density":7.078050284486492,"density_atomic":0.038265834988740345,"volume":78.3989164455119,"volume_molar":15.737643675545053,"formula_full":"Hf1 Si1 Te1","formula_reduced":"HfSiTe","formula_anonymous":"ABC","energy_above_hull":3.033206455555556,"spacegroup":99},{"id":"jvasp-120043","created_at":"2022-09-04T14:38:53.419500Z","updated_at":"2022-09-04T14:38:53.419525Z","structure_string":"C1 Cl1 F1\n1.0\n3.975402 0.000000 -0.000000\n-1.987701 3.442799 0.000000\n-0.000000 -0.000000 2.999661\nC Cl F\n1 1 1\ndirect\n0.000000 0.000000 0.000000 C\n0.333332 0.666666 0.000000 Cl\n0.666666 0.333333 0.000000 F\n","nsites":3,"nelements":3,"elements":["C","Cl","F"],"chemical_system":"C-Cl-F","density":2.688179601366042,"density_atomic":0.07307290248308645,"volume":41.05489036369376,"volume_molar":8.24127762188438,"formula_full":"C1 Cl1 F1","formula_reduced":"CClF","formula_anonymous":"ABC","energy_above_hull":2.3161981166666665,"spacegroup":187},{"id":"jvasp-117588","created_at":"2022-09-04T14:38:53.417586Z","updated_at":"2022-09-04T14:38:53.417616Z","structure_string":"Ba2 N1 F1\n1.0\n2.008785 1.159773 6.663910\n-2.008785 1.159773 6.663910\n-0.000000 -2.319545 6.663910\nBa N F\n2 1 1\ndirect\n0.757284 0.757284 0.757284 Ba\n0.242715 0.242715 0.242716 Ba\n0.500000 0.500000 0.500000 N\n0.000000 0.000000 0.000000 F\n","nsites":4,"nelements":3,"elements":["Ba","N","F"],"chemical_system":"Ba-F-N","density":5.484438462758391,"density_atomic":0.042941112523795254,"volume":93.15082364909509,"volume_molar":14.024184298119687,"formula_full":"Ba2 N1 F1","formula_reduced":"Ba2NF","formula_anonymous":"ABC2","energy_above_hull":0.6386738681249999,"spacegroup":166}]}