Materials Data on ScGa2Ni by Materials Project

Dataset · Wed Jul 15 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1187803· OSTI ID:1187803

The Materials Project

ScNiGa2 crystallizes in the orthorhombic Cmcm space group. The structure is three-dimensional. Sc is bonded in a 1-coordinate geometry to three equivalent Ni and ten equivalent Ga atoms. There are one shorter (2.70 Å) and two longer (2.92 Å) Sc–Ni bond lengths. There are a spread of Sc–Ga bond distances ranging from 2.86–3.15 Å. Ni is bonded in a 9-coordinate geometry to three equivalent Sc and six equivalent Ga atoms. There are two shorter (2.45 Å) and four longer (2.49 Å) Ni–Ga bond lengths. Ga is bonded in a 10-coordinate geometry to five equivalent Sc, three equivalent Ni, and two equivalent Ga atoms. There are one shorter (2.60 Å) and one longer (2.71 Å) Ga–Ga bond lengths.

• 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: 1187803
• Report Number(s): mp-11401
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
ScGa2Ni
Ga-Ni-Sc