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Title: Materials Data on CaHg3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1309853· OSTI ID:1309853

CaHg3 crystallizes in the hexagonal P6_3/mmc space group. The structure is three-dimensional. Ca is bonded to twelve equivalent Hg atoms to form a mixture of face and corner-sharing CaHg12 cuboctahedra. There are six shorter (3.28 Å) and six longer (3.38 Å) Ca–Hg bond lengths. Hg is bonded in a distorted see-saw-like geometry to four equivalent Ca 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:
1309853
Report Number(s):
mp-863648
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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