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Title: Materials Data on Li2BiO3 by Materials Project

Abstract

Li2BiO3 is Enargite-like structured and crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. Li is bonded to four O atoms to form LiO4 tetrahedra that share corners with five equivalent BiO4 tetrahedra and corners with seven equivalent LiO4 tetrahedra. There are a spread of Li–O bond distances ranging from 2.00–2.14 Å. Bi is bonded to four O atoms to form BiO4 tetrahedra that share corners with two equivalent BiO4 tetrahedra and corners with ten equivalent LiO4 tetrahedra. There are a spread of Bi–O bond distances ranging from 2.09–2.26 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Li and one Bi atom to form corner-sharing OLi3Bi tetrahedra. In the second O site, O is bonded to two equivalent Li and two equivalent Bi atoms to form corner-sharing OLi2Bi2 tetrahedra.

Publication Date:
Other Number(s):
mp-755487
DOE Contract Number:  
AC02-05CH11231; EDCBEE
Product Type:
Dataset
Research Org.:
Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; Li2BiO3; Bi-Li-O
OSTI Identifier:
1290031
DOI:
10.17188/1290031

Citation Formats

The Materials Project. Materials Data on Li2BiO3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1290031.
The Materials Project. Materials Data on Li2BiO3 by Materials Project. United States. doi:10.17188/1290031.
The Materials Project. 2020. "Materials Data on Li2BiO3 by Materials Project". United States. doi:10.17188/1290031. https://www.osti.gov/servlets/purl/1290031. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1290031,
title = {Materials Data on Li2BiO3 by Materials Project},
author = {The Materials Project},
abstractNote = {Li2BiO3 is Enargite-like structured and crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. Li is bonded to four O atoms to form LiO4 tetrahedra that share corners with five equivalent BiO4 tetrahedra and corners with seven equivalent LiO4 tetrahedra. There are a spread of Li–O bond distances ranging from 2.00–2.14 Å. Bi is bonded to four O atoms to form BiO4 tetrahedra that share corners with two equivalent BiO4 tetrahedra and corners with ten equivalent LiO4 tetrahedra. There are a spread of Bi–O bond distances ranging from 2.09–2.26 Å. There are two inequivalent O sites. In the first O site, O is bonded to three equivalent Li and one Bi atom to form corner-sharing OLi3Bi tetrahedra. In the second O site, O is bonded to two equivalent Li and two equivalent Bi atoms to form corner-sharing OLi2Bi2 tetrahedra.},
doi = {10.17188/1290031},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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