Materials Data on Tb(CuS)2 by Materials Project

Dataset · Thu Jul 23 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1350345· OSTI ID:1350345

The Materials Project

Tb(CuS)2 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. Tb is bonded to six equivalent Cu and six equivalent S atoms to form distorted face-sharing TbCu6S6 cuboctahedra. All Tb–Cu bond lengths are 3.10 Å. All Tb–S bond lengths are 2.86 Å. Cu is bonded in a 4-coordinate geometry to three equivalent Tb and four equivalent S atoms. There are three shorter (2.31 Å) and one longer (2.55 Å) Cu–S bond lengths. S is bonded in a 7-coordinate geometry to three equivalent Tb and four equivalent Cu 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: 1350345
• Report Number(s): mp-1018637
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
Tb(CuS)2
Cu-S-Tb