Materials Data on ZrNiGe by Materials Project

Dataset · Sat May 02 04:00:00 EDT 2020

DOI:https://doi.org/10.17188/1676099· OSTI ID:1676099

ZrNiGe crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Zr is bonded in a 11-coordinate geometry to six equivalent Ni and five equivalent Ge atoms. There are a spread of Zr–Ni bond distances ranging from 2.88–3.12 Å. There are two shorter (2.77 Å) and three longer (2.80 Å) Zr–Ge bond lengths. Ni is bonded in a 12-coordinate geometry to six equivalent Zr, two equivalent Ni, and four equivalent Ge atoms. Both Ni–Ni bond lengths are 2.83 Å. There are a spread of Ni–Ge bond distances ranging from 2.43–2.55 Å. Ge is bonded in a 9-coordinate geometry to five equivalent Zr and four equivalent Ni atoms.

• Research Organization: LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
• Sponsoring Organization: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
• Contributing Organization: The Materials Project; MIT; UC Berkeley; Duke; U Louvain
• DOE Contract Number: AC02-05CH11231
• OSTI ID: 1676099
• Report Number(s): mp-1102687
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
Ge-Ni-Zr
ZrNiGe
crystal structure