Materials Data on HfI3 by Materials Project

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

DOI:https://doi.org/10.17188/1274173· OSTI ID:1274173

The Materials Project

HfI3 crystallizes in the hexagonal P6_3/mcm space group. The structure is one-dimensional and consists of one HfI3 ribbon oriented in the (0, 0, 1) direction. Hf is bonded to six equivalent I atoms to form face-sharing HfI6 octahedra. All Hf–I bond lengths are 2.90 Å. I is bonded in a 2-coordinate geometry to two equivalent Hf 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: 1274173
• Report Number(s): mp-568002
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
HfI3
Hf-I