skip to main content
OSTI.GOV title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Lu3Sn by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1315197· OSTI ID:1315197

Lu3Sn is Uranium Silicide-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded to eight Lu and four equivalent Sn atoms to form distorted LuLu8Sn4 cuboctahedra that share corners with twelve equivalent LuLu8Sn4 cuboctahedra, edges with eight equivalent LuLu8Sn4 cuboctahedra, edges with eight equivalent SnLu12 cuboctahedra, faces with four equivalent SnLu12 cuboctahedra, and faces with ten equivalent LuLu8Sn4 cuboctahedra. There are four shorter (3.23 Å) and four longer (3.43 Å) Lu–Lu bond lengths. All Lu–Sn bond lengths are 3.43 Å. In the second Lu site, Lu is bonded in a square co-planar geometry to eight equivalent Lu and four equivalent Sn atoms. All Lu–Sn bond lengths are 3.23 Å. Sn is bonded to twelve Lu atoms to form SnLu12 cuboctahedra that share corners with four equivalent SnLu12 cuboctahedra, edges with eight equivalent SnLu12 cuboctahedra, edges with sixteen equivalent LuLu8Sn4 cuboctahedra, faces with four equivalent SnLu12 cuboctahedra, and faces with eight equivalent LuLu8Sn4 cuboctahedra.

Research Organization:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Contributing Organization:
MIT; UC Berkeley; Duke; U Louvain
DOE Contract Number:
AC02-05CH11231; EDCBEE
OSTI ID:
1315197
Report Number(s):
mp-976357
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

Similar Records

Materials Data on Ce3Zn by Materials Project
Dataset · Thu Jul 23 00:00:00 EDT 2020 · OSTI ID:1315197

Materials Data on Th3W by Materials Project
Dataset · Fri Jan 11 00:00:00 EST 2019 · OSTI ID:1315197

Materials Data on Na3Cd by Materials Project
Dataset · Tue May 05 00:00:00 EDT 2020 · OSTI ID:1315197