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DOE OSTI2020

Materials Data on PmSm3 by Materials Project

Sm3Pm is alpha La-derived structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Sm sites. In the first Sm site, Sm is bonded to eight Sm and four equivalent Pm atoms to form SmPm4Sm8 cuboctahedra that share corners with twelve equivalent SmPm4Sm8 cuboctahedra, edges with eight equivalent PmSm12 cuboctahedra, edges with sixteen SmPm4Sm8 cuboctahedra, faces with four equivalent PmSm12 cuboctahedra, and faces with fourteen SmPm4Sm8 cuboctahedra. All Sm–Sm bond lengths are 3.65 Å. All Sm–Pm bond lengths are 3.65 Å. In the second Sm site, Sm is bonded to eight equivalent Sm and four equivalent Pm atoms to form SmPm4Sm8 cuboctahedra that share corners with four equivalent SmPm4Sm8 cuboctahedra, corners with eight equivalent PmSm12 cuboctahedra, edges with twenty-four SmPm4Sm8 cuboctahedra, faces with six equivalent PmSm12 cuboctahedra, and faces with twelve SmPm4Sm8 cuboctahedra. All Sm–Pm bond lengths are 3.65 Å. Pm is bonded to twelve Sm atoms to form PmSm12 cuboctahedra that share corners with four equivalent PmSm12 cuboctahedra, corners with eight equivalent SmPm4Sm8 cuboctahedra, edges with eight equivalent PmSm12 cuboctahedra, edges with sixteen equivalent SmPm4Sm8 cuboctahedra, faces with four equivalent PmSm12 cuboctahedra, and faces with fourteen SmPm4Sm8 cuboctahedra.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on PmSm3 by Materials Project

Sm3Pm is Uranium Silicide structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Sm is bonded to eight equivalent Sm and four equivalent Pm atoms to form SmPm4Sm8 cuboctahedra that share corners with twelve equivalent SmPm4Sm8 cuboctahedra, edges with eight equivalent PmSm12 cuboctahedra, edges with sixteen equivalent SmPm4Sm8 cuboctahedra, faces with four equivalent PmSm12 cuboctahedra, and faces with fourteen equivalent SmPm4Sm8 cuboctahedra. All Sm–Sm bond lengths are 3.64 Å. All Sm–Pm bond lengths are 3.64 Å. Pm is bonded to twelve equivalent Sm atoms to form PmSm12 cuboctahedra that share corners with twelve equivalent PmSm12 cuboctahedra, edges with twenty-four equivalent SmPm4Sm8 cuboctahedra, faces with six equivalent PmSm12 cuboctahedra, and faces with twelve equivalent SmPm4Sm8 cuboctahedra.

36 MATERIALS SCIENCE↗

DOE OSTI2020

Materials Data on PmSm3 by Materials Project

Sm3Pm is Magnesium-derived structured and crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Sm is bonded to eight equivalent Sm and four equivalent Pm atoms to form SmPm4Sm8 cuboctahedra that share corners with four equivalent PmSm12 cuboctahedra, corners with fourteen equivalent SmPm4Sm8 cuboctahedra, edges with six equivalent PmSm12 cuboctahedra, edges with twelve equivalent SmPm4Sm8 cuboctahedra, faces with four equivalent PmSm12 cuboctahedra, and faces with sixteen equivalent SmPm4Sm8 cuboctahedra. There are six shorter (3.65 Å) and two longer (3.67 Å) Sm–Sm bond lengths. All Sm–Pm bond lengths are 3.66 Å. Pm is bonded to twelve equivalent Sm atoms to form PmSm12 cuboctahedra that share corners with six equivalent PmSm12 cuboctahedra, corners with twelve equivalent SmPm4Sm8 cuboctahedra, edges with eighteen equivalent SmPm4Sm8 cuboctahedra, faces with eight equivalent PmSm12 cuboctahedra, and faces with twelve equivalent SmPm4Sm8 cuboctahedra.

36 MATERIALS SCIENCE↗