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Materials Data on RbInCl3 by Materials Project

RbInCl3 crystallizes in the trigonal R3c space group. The structure is three-dimensional. Rb1+ is bonded in a 6-coordinate geometry to six equivalent Cl1- atoms. There are three shorter (3.45 Å) and three longer (3.63 Å) Rb–Cl bond lengths. In2+ is bonded to six equivalent Cl1- atoms to form corner-sharing InCl6 octahedra. The corner-sharing octahedral tilt angles are 17°. There are three shorter (2.74 Å) and three longer (2.77 Å) In–Cl bond lengths. Cl1- is bonded in a 4-coordinate geometry to two equivalent Rb1+ and two equivalent In2+ atoms.

36 MATERIALS SCIENCE↗

Materials Data on RbInCl3 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗

Materials Data on Rb3InCl6 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations

36 MATERIALS SCIENCE↗