DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on LaCO4 by Materials Project

Abstract

LaCO4 crystallizes in the orthorhombic P2_12_12_1 space group. The structure is three-dimensional. La is bonded in a 2-coordinate geometry to ten O atoms. There are a spread of La–O bond distances ranging from 2.37–3.05 Å. C is bonded in a trigonal planar geometry to three O atoms. There are a spread of C–O bond distances ranging from 1.29–1.31 Å. There are four inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to two equivalent La atoms. In the second O site, O is bonded in a distorted single-bond geometry to three equivalent La and one C atom. In the third O site, O is bonded in a distorted single-bond geometry to two equivalent La and one C atom. In the fourth O site, O is bonded in a single-bond geometry to three equivalent La and one C atom.

Authors:
Publication Date:
Other Number(s):
mp-1211254
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; LaCO4; C-La-O
OSTI Identifier:
1674837
DOI:
https://doi.org/10.17188/1674837

Citation Formats

The Materials Project. Materials Data on LaCO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1674837.
The Materials Project. Materials Data on LaCO4 by Materials Project. United States. doi:https://doi.org/10.17188/1674837
The Materials Project. 2020. "Materials Data on LaCO4 by Materials Project". United States. doi:https://doi.org/10.17188/1674837. https://www.osti.gov/servlets/purl/1674837. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1674837,
title = {Materials Data on LaCO4 by Materials Project},
author = {The Materials Project},
abstractNote = {LaCO4 crystallizes in the orthorhombic P2_12_12_1 space group. The structure is three-dimensional. La is bonded in a 2-coordinate geometry to ten O atoms. There are a spread of La–O bond distances ranging from 2.37–3.05 Å. C is bonded in a trigonal planar geometry to three O atoms. There are a spread of C–O bond distances ranging from 1.29–1.31 Å. There are four inequivalent O sites. In the first O site, O is bonded in a bent 120 degrees geometry to two equivalent La atoms. In the second O site, O is bonded in a distorted single-bond geometry to three equivalent La and one C atom. In the third O site, O is bonded in a distorted single-bond geometry to two equivalent La and one C atom. In the fourth O site, O is bonded in a single-bond geometry to three equivalent La and one C atom.},
doi = {10.17188/1674837},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}