Materials Data on CaLaAl4 by Materials Project

Dataset · Sat May 02 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1747119· OSTI ID:1747119

The Materials Project

CaLaAl4 is Hexagonal Laves-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Ca is bonded in a 12-coordinate geometry to four equivalent La and twelve equivalent Al atoms. All Ca–La bond lengths are 3.50 Å. All Ca–Al bond lengths are 3.35 Å. La is bonded in a 12-coordinate geometry to four equivalent Ca and twelve equivalent Al atoms. All La–Al bond lengths are 3.35 Å. Al is bonded to three equivalent Ca, three equivalent La, and six equivalent Al atoms to form a mixture of face, edge, and corner-sharing AlCa3La3Al6 cuboctahedra. All Al–Al bond lengths are 2.86 Å.

• 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: 1747119
• Report Number(s): mp-1227048
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
CaLaAl4
Al-Ca-La