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Title: Materials Data on LiHO2 by Materials Project

Dataset ·
DOI:https://doi.org/10.17188/1279314· OSTI ID:1279314

LiHO2 crystallizes in the monoclinic C2/m space group. The structure is one-dimensional and consists of two LiHO2 ribbons oriented in the (0, 0, 1) direction. Li is bonded to four O atoms to form a mixture of edge and corner-sharing LiO4 trigonal pyramids. There is two shorter (1.97 Å) and two longer (1.99 Å) Li–O bond length. H is bonded in a single-bond geometry to one O atom. The H–O bond length is 0.98 Å. There are two inequivalent O sites. In the first O site, O is bonded in a 1-coordinate geometry to two equivalent Li and one H atom. In the second O site, O is bonded in a bent 120 degrees geometry to two equivalent Li 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:
1279314
Report Number(s):
mp-632417
Resource Relation:
Related Information: https://materialsproject.org/citing
Country of Publication:
United States
Language:
English

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