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Materials Data on SnRh3 by Materials Project

Rh3Sn is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Rh sites. In the first Rh site, Rh is bonded to eight Rh and four equivalent Sn atoms to form distorted RhSn4Rh8 cuboctahedra that share corners with twelve equivalent RhSn4Rh8 cuboctahedra, edges with eight equivalent SnRh12 cuboctahedra, edges with sixteen RhSn4Rh8 cuboctahedra, faces with four equivalent SnRh12 cuboctahedra, and faces with fourteen RhSn4Rh8 cuboctahedra. There are four shorter (2.78 Å) and four longer (2.86 Å) Rh–Rh bond lengths. All Rh–Sn bond lengths are 2.78 Å. In the second Rh site, Rh is bonded to eight equivalent Rh and four equivalent Sn atoms to form RhSn4Rh8 cuboctahedra that share corners with four equivalent RhSn4Rh8 cuboctahedra, corners with eight equivalent SnRh12 cuboctahedra, edges with twenty-four RhSn4Rh8 cuboctahedra, faces with six equivalent SnRh12 cuboctahedra, and faces with twelve RhSn4Rh8 cuboctahedra. All Rh–Sn bond lengths are 2.86 Å. Sn is bonded to twelve Rh atoms to form SnRh12 cuboctahedra that share corners with four equivalent SnRh12 cuboctahedra, corners with eight equivalent RhSn4Rh8 cuboctahedra, edges with eight equivalent SnRh12 cuboctahedra, edges with sixteen equivalent RhSn4Rh8 cuboctahedra, faces with four equivalent SnRh12 cuboctahedra, and faces with fourteen RhSn4Rh8 cuboctahedra.

36 MATERIALS SCIENCE↗

Materials Data on Ho3Si2(SnRh3)3 by Materials Project

Ho3Si2(Rh3Sn)3 crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. Ho is bonded in a 12-coordinate geometry to ten Rh and two equivalent Si atoms. There are a spread of Ho–Rh bond distances ranging from 2.89–3.15 Å. Both Ho–Si bond lengths are 3.00 Å. There are two inequivalent Rh sites. In the first Rh site, Rh is bonded in a 8-coordinate geometry to four equivalent Ho, two equivalent Sn, and two equivalent Si atoms. Both Rh–Sn bond lengths are 2.78 Å. Both Rh–Si bond lengths are 2.42 Å. In the second Rh site, Rh is bonded in a 6-coordinate geometry to two equivalent Ho and four equivalent Sn atoms. All Rh–Sn bond lengths are 2.72 Å. Sn is bonded in a distorted body-centered cubic geometry to eight Rh atoms. Si is bonded in a 9-coordinate geometry to three equivalent Ho and six equivalent Rh atoms.

36 MATERIALS SCIENCE↗