Materials Data on BaGaCu2 by Materials Project

Dataset · Thu Jul 16 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1325051· OSTI ID:1325051

The Materials Project

BaCu2Ga crystallizes in the trigonal R-3m space group. The structure is three-dimensional. Ba is bonded in a 8-coordinate geometry to eight equivalent Cu atoms. There are two shorter (3.23 Å) and six longer (3.52 Å) Ba–Cu bond lengths. Cu is bonded in a 10-coordinate geometry to four equivalent Ba, three equivalent Cu, and three equivalent Ga atoms. All Cu–Cu bond lengths are 2.60 Å. All Cu–Ga bond lengths are 2.52 Å. Ga is bonded in a distorted hexagonal planar geometry to six 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: 1325051
• Report Number(s): mp-1008511
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
BaGaCu2
Ba-Cu-Ga