Materials Data on NaVO2 by Materials Project
NaVO2 is Caswellsilverite structured and crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Na1+ is bonded to six equivalent O2- atoms to form NaO6 octahedra that share corners with six equivalent VO6 octahedra, edges with six equivalent NaO6 octahedra, and edges with six equivalent VO6 octahedra. The corner-sharing octahedral tilt angles are 11°. All Na–O bond lengths are 2.40 Å. V3+ is bonded to six equivalent O2- atoms to form VO6 octahedra that share corners with six equivalent NaO6 octahedra, edges with six equivalent NaO6 octahedra, and edges with six equivalent VO6 octahedra. The corner-sharing octahedral tilt angles are 11°. All V–O bond lengths are 2.08 Å. O2- is bonded to three equivalent Na1+ and three equivalent V3+ atoms to form a mixture of corner and edge-sharing ONa3V3 octahedra. The corner-sharing octahedral tilt angles are 0°.