Materials Data on Lu5NiPb3 by Materials Project

Dataset · Sat Jul 18 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1274836· OSTI ID:1274836

The Materials Project

Lu5NiPb3 crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded in a 7-coordinate geometry to two equivalent Ni and five equivalent Pb atoms. Both Lu–Ni bond lengths are 2.68 Å. There are a spread of Lu–Pb bond distances ranging from 3.14–3.60 Å. In the second Lu site, Lu is bonded in a 6-coordinate geometry to six equivalent Pb atoms. All Lu–Pb bond lengths are 3.20 Å. Ni is bonded to six equivalent Lu atoms to form face-sharing NiLu6 octahedra. Pb is bonded in a 9-coordinate geometry to nine Lu atoms.

• 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: 1274836
• Report Number(s): mp-568942
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Lu5NiPb3
Lu-Ni-Pb