{"count":55712,"next":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=553","previous":"https://simmate.org/third-parties/JarvisStructure/?format=json&ordering=-formula_anonymous&page=551","results":[{"id":"jvasp-35807","created_at":"2022-09-04T14:37:29.927755Z","updated_at":"2022-09-04T14:37:29.927791Z","structure_string":"Y1 Pd3 C1\n1.0\n4.285888 0.000000 0.000000\n-0.000000 4.285888 -0.000000\n0.000000 0.000000 4.285888\nY Pd C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Y\n0.000000 0.500000 0.500000 Pd\n0.500000 0.500000 0.000000 Pd\n0.500000 0.000000 0.500000 Pd\n0.500000 0.500000 0.500000 C\n","nsites":5,"nelements":3,"elements":["Y","Pd","C"],"chemical_system":"C-Pd-Y","density":8.862545034450791,"density_atomic":0.0635107952927713,"volume":78.72677356583334,"volume_molar":9.48207423988191,"formula_full":"Y1 Pd3 C1","formula_reduced":"YPd3C","formula_anonymous":"ABC3","energy_above_hull":2.91268851,"spacegroup":221},{"id":"jvasp-35651","created_at":"2022-09-04T14:37:28.481743Z","updated_at":"2022-09-04T14:37:28.481762Z","structure_string":"Ga1 Pt3 C1\n1.0\n4.207240 0.000000 -0.000000\n0.000000 4.207240 -0.000000\n-0.000000 0.000000 4.208993\nGa Pt C\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Ga\n0.000000 0.500000 0.500000 Pt\n0.500000 0.000000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.500000 0.500000 C\n","nsites":5,"nelements":3,"elements":["Ga","Pt","C"],"chemical_system":"C-Ga-Pt","density":14.865956003670377,"density_atomic":0.06711154348362189,"volume":74.50283126359946,"volume_molar":8.973330737758493,"formula_full":"Ga1 Pt3 C1","formula_reduced":"GaPt3C","formula_anonymous":"ABC3","energy_above_hull":2.943333305,"spacegroup":221},{"id":"jvasp-36515","created_at":"2022-09-04T14:37:33.601306Z","updated_at":"2022-09-04T14:37:33.601326Z","structure_string":"Ca3 Sb1 As1\n1.0\n5.712662 0.000000 0.000000\n-0.000000 5.712662 0.000000\n0.000000 -0.000000 5.712662\nCa Sb As\n3 1 1\ndirect\n0.000000 0.500000 0.500000 Ca\n0.500000 0.000000 0.500000 Ca\n0.500000 0.500000 0.000000 Ca\n0.500000 0.500000 0.500000 Sb\n0.000000 0.000000 0.000000 As\n","nsites":5,"nelements":3,"elements":["Ca","Sb","As"],"chemical_system":"As-Ca-Sb","density":2.8227806264926936,"density_atomic":0.02681973098391896,"volume":186.42990874882327,"volume_molar":22.454143047187387,"formula_full":"Ca3 Sb1 As1","formula_reduced":"Ca3SbAs","formula_anonymous":"ABC3","energy_above_hull":0.459263822,"spacegroup":221},{"id":"jvasp-36674","created_at":"2022-09-04T14:37:27.446729Z","updated_at":"2022-09-04T14:37:27.446751Z","structure_string":"Cd1 Ni3 N1\n1.0\n3.859859 0.000000 -0.000000\n0.000000 3.859859 0.000000\n0.000000 0.000000 3.859859\nCd Ni N\n1 3 1\ndirect\n0.000000 0.000000 0.000000 Cd\n0.500000 0.500000 0.000000 Ni\n0.500000 0.000000 0.500000 Ni\n0.000000 0.500000 0.500000 Ni\n0.500000 0.500000 0.500000 N\n","nsites":5,"nelements":3,"elements":["Cd","Ni","N"],"chemical_system":"Cd-N-Ni","density":8.734883976765316,"density_atomic":0.08694721657328475,"volume":57.50615369941919,"volume_molar":6.926203042881942,"formula_full":"Cd1 Ni3 N1","formula_reduced":"CdNi3N","formula_anonymous":"ABC3","energy_above_hull":1.3328080400000002,"spacegroup":221},{"id":"jvasp-35649","created_at":"2022-09-04T14:37:28.287773Z","updated_at":"2022-09-04T14:37:28.287795Z","structure_string":"Er3 Al1 N1\n1.0\n4.700768 0.000000 0.000000\n0.000000 4.700768 0.000000\n-0.000000 0.000000 4.700768\nEr Al N\n3 1 1\ndirect\n0.500000 0.500000 0.000000 Er\n0.500000 0.000000 0.500000 Er\n0.000000 0.500000 0.500000 Er\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 N\n","nsites":5,"nelements":3,"elements":["Er","Al","N"],"chemical_system":"Al-Er-N","density":8.676701758418487,"density_atomic":0.04813528540863425,"volume":103.87390367697138,"volume_molar":12.510865384668064,"formula_full":"Er3 Al1 N1","formula_reduced":"Er3AlN","formula_anonymous":"ABC3","energy_above_hull":2.12212521,"spacegroup":221},{"id":"jvasp-35648","created_at":"2022-09-04T14:37:27.366938Z","updated_at":"2022-09-04T14:37:27.366957Z","structure_string":"Dy3 Al1 N1\n1.0\n4.760789 -0.000000 -0.000000\n0.000000 4.760789 0.000000\n0.000000 0.000000 4.760789\nDy Al N\n3 1 1\ndirect\n0.500000 0.500000 0.000000 Dy\n0.500000 0.000000 0.500000 Dy\n0.000000 0.500000 0.500000 Dy\n0.000000 0.000000 0.000000 Al\n0.500000 0.500000 0.500000 N\n","nsites":5,"nelements":3,"elements":["Dy","Al","N"],"chemical_system":"Al-Dy-N","density":8.132941017354423,"density_atomic":0.04633756443280248,"volume":107.90381542929104,"volume_molar":12.996239301125012,"formula_full":"Dy3 Al1 N1","formula_reduced":"Dy3AlN","formula_anonymous":"ABC3","energy_above_hull":2.15543911,"spacegroup":221},{"id":"jvasp-14202","created_at":"2022-09-04T14:37:27.354174Z","updated_at":"2022-09-04T14:37:27.354196Z","structure_string":"U2 Fe2 S6\n1.0\n3.732353 -0.000000 -0.000000\n-1.866177 5.398764 0.000000\n0.000000 -0.000000 8.481530\nU Fe S\n2 2 6\ndirect\n0.237053 0.474107 0.750000 U\n0.762945 0.525892 0.250000 U\n0.000000 0.000000 0.000000 Fe\n0.000000 0.000000 0.500000 Fe\n0.636609 0.273219 0.550820 S\n0.363389 0.726781 0.449180 S\n0.363389 0.726781 0.050820 S\n0.636609 0.273219 0.949180 S\n0.921387 0.842775 0.750000 S\n0.078611 0.157224 0.250000 S\n","nsites":10,"nelements":3,"elements":["U","Fe","S"],"chemical_system":"Fe-S-U","density":7.579999415522743,"density_atomic":0.0585125118748513,"volume":170.90361838145603,"volume_molar":10.292056462864517,"formula_full":"U2 Fe2 S6","formula_reduced":"UFeS3","formula_anonymous":"ABC3","energy_above_hull":3.0078423,"spacegroup":63},{"id":"jvasp-54710","created_at":"2022-09-04T14:37:28.231275Z","updated_at":"2022-09-04T14:37:28.231303Z","structure_string":"H3 Br1 O1\n1.0\n2.536606 1.464510 2.914355\n-2.536606 1.464510 2.914355\n-0.000000 -2.929020 2.914355\nH Br O\n3 1 1\ndirect\n0.303072 0.635806 0.303072 H\n0.303072 0.303072 0.635806 H\n0.635806 0.303072 0.303072 H\n-0.002507 -0.002507 -0.002507 Br\n0.451411 0.451411 0.451411 O\n","nsites":5,"nelements":3,"elements":["H","Br","O"],"chemical_system":"Br-H-O","density":2.528866146966854,"density_atomic":0.07697167627623684,"volume":64.95895947563805,"volume_molar":7.823839951708563,"formula_full":"H3 Br1 O1","formula_reduced":"H3BrO","formula_anonymous":"ABC3","energy_above_hull":1.9923175209999997,"spacegroup":160},{"id":"jvasp-35805","created_at":"2022-09-04T14:37:29.972838Z","updated_at":"2022-09-04T14:37:29.972859Z","structure_string":"Sc1 B1 Pt3\n1.0\n4.256761 -0.000000 0.000000\n-0.000000 4.256761 -0.000000\n-0.000000 -0.000000 4.256761\nSc B Pt\n1 1 3\ndirect\n0.000000 0.000000 0.000000 Sc\n0.500000 0.500000 0.500000 B\n0.000000 0.500000 0.500000 Pt\n0.500000 0.500000 0.000000 Pt\n0.500000 0.000000 0.500000 Pt\n","nsites":5,"nelements":3,"elements":["Sc","B","Pt"],"chemical_system":"B-Pt-Sc","density":13.800097006767384,"density_atomic":0.06482345930000234,"volume":77.13256981334564,"volume_molar":9.290063851929887,"formula_full":"Sc1 B1 Pt3","formula_reduced":"ScBPt3","formula_anonymous":"ABC3","energy_above_hull":3.059460406666666,"spacegroup":221},{"id":"jvasp-50932","created_at":"2022-09-04T14:37:29.636936Z","updated_at":"2022-09-04T14:37:29.636955Z","structure_string":"Y2 Bi2 O6\n1.0\n3.011181 1.738507 4.985528\n-3.011181 1.738506 4.985528\n-0.000000 -3.477012 4.985528\nY Bi O\n2 2 6\ndirect\n0.140586 0.140586 0.140585 Y\n0.859416 0.859416 0.859413 Y\n0.359724 0.359724 0.359723 Bi\n0.640277 0.640277 0.640276 Bi\n0.008530 0.781432 0.455788 O\n0.544212 0.991471 0.218567 O\n0.218569 0.544212 0.991470 O\n0.781432 0.455789 0.008529 O\n0.455789 0.008530 0.781431 O\n0.991471 0.218569 0.544211 O\n","nsites":10,"nelements":3,"elements":["Y","Bi","O"],"chemical_system":"Bi-O-Y","density":7.3355828057657035,"density_atomic":0.06385934989014837,"volume":156.59414036005882,"volume_molar":9.430319554394712,"formula_full":"Y2 Bi2 O6","formula_reduced":"YBiO3","formula_anonymous":"ABC3","energy_above_hull":1.83797005,"spacegroup":148},{"id":"jvasp-46537","created_at":"2022-09-04T14:37:27.249447Z","updated_at":"2022-09-04T14:37:27.249478Z","structure_string":"Tl2 Co2 O6\n1.0\n2.370838 -4.601292 -0.000001\n3.566126 4.748902 0.100417\n-0.000000 -2.911439 4.279753\nTl Co O\n2 2 6\ndirect\n0.127132 0.381395 0.127132 Tl\n0.872869 0.618606 0.872868 Tl\n0.337698 0.013095 0.337698 Co\n0.662303 0.986906 0.662303 Co\n0.058440 0.205183 0.467882 O\n0.467883 0.205183 0.678862 O\n0.678862 0.205184 0.058440 O\n0.321139 0.794817 0.941560 O\n0.532118 0.794818 0.321139 O\n0.941561 0.794818 0.532118 O\n","nsites":10,"nelements":3,"elements":["Tl","Co","O"],"chemical_system":"Co-O-Tl","density":8.680658741829038,"density_atomic":0.08396029755499414,"volume":119.10391329246997,"volume_molar":7.1726053091408914,"formula_full":"Tl2 Co2 O6","formula_reduced":"TlCoO3","formula_anonymous":"ABC3","energy_above_hull":1.9148408,"spacegroup":148},{"id":"jvasp-36532","created_at":"2022-09-04T14:37:14.122195Z","updated_at":"2022-09-04T14:37:14.122217Z","structure_string":"Hf6 Zn2 N2\n1.0\n1.655492 -5.637943 -0.000000\n1.655492 5.637943 0.000000\n0.000000 -0.000000 8.779493\nHf Zn N\n6 2 2\ndirect\n0.628291 0.371708 0.047491 Hf\n0.371708 0.628291 0.547491 Hf\n0.371708 0.628291 0.952508 Hf\n0.628291 0.371708 0.452509 Hf\n0.953048 0.046951 0.250000 Hf\n0.046951 0.953048 0.750000 Hf\n0.255399 0.744600 0.250000 Zn\n0.744600 0.255399 0.750000 Zn\n0.000000 0.000000 0.000000 N\n0.000000 0.000000 0.500000 N\n","nsites":10,"nelements":3,"elements":["Hf","Zn","N"],"chemical_system":"Hf-N-Zn","density":12.4602365265533,"density_atomic":0.06101727385409088,"volume":163.88801675920095,"volume_molar":9.869567058011473,"formula_full":"Hf6 Zn2 N2","formula_reduced":"Hf3ZnN","formula_anonymous":"ABC3","energy_above_hull":4.07409253,"spacegroup":63}]}