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Title: Materials Data on Ca(HgO2)3 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1706752· OSTI ID:1706752

Ca(HgO2)2HgO2 crystallizes in the orthorhombic Cmmm space group. The structure is two-dimensional and consists of two mercury molecules; four water molecules; and one Ca(HgO2)2 sheet oriented in the (0, 0, 1) direction. In the Ca(HgO2)2 sheet, Ca is bonded in a distorted square co-planar geometry to four equivalent O atoms. All Ca–O bond lengths are 2.21 Å. Hg is bonded in a linear geometry to two equivalent O atoms. Both Hg–O bond lengths are 1.94 Å. O is bonded in a linear geometry to one Ca and one Hg atom.

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:
1706752
Report Number(s):
mp-1207338
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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