Materials Data on BaHg3 by Materials Project

Dataset · Wed Jul 22 00:00:00 EDT 2020

DOI:https://doi.org/10.17188/1312147· OSTI ID:1312147

The Materials Project

BaHg3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ba is bonded to twelve equivalent Hg atoms to form a mixture of distorted corner and face-sharing BaHg12 cuboctahedra. There are six shorter (3.58 Å) and six longer (3.72 Å) Ba–Hg bond lengths. Hg is bonded in a 4-coordinate geometry to four equivalent Ba 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: 1312147
• Report Number(s): mp-867770
• Resource Relation: Related Information: https://materialsproject.org/citing
• Country of Publication: United States
• Language: English

Related Subjects

36 MATERIALS SCIENCE
crystal structure
BaHg3
Ba-Hg