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Title: Materials Data on La2PBr2 by Materials Project

Abstract

La2PBr2 is MAX Phase-like structured and crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one La2PBr2 sheet oriented in the (0, 0, 1) direction. La+2.50+ is bonded to three equivalent P3- and three equivalent Br1- atoms to form a mixture of corner and edge-sharing LaP3Br3 octahedra. The corner-sharing octahedral tilt angles are 0°. All La–P bond lengths are 2.96 Å. All La–Br bond lengths are 3.10 Å. P3- is bonded to six equivalent La+2.50+ atoms to form edge-sharing PLa6 octahedra. Br1- is bonded in a 3-coordinate geometry to three equivalent La+2.50+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-570988
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; La2PBr2; Br-La-P
OSTI Identifier:
1276037
DOI:
https://doi.org/10.17188/1276037

Citation Formats

The Materials Project. Materials Data on La2PBr2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1276037.
The Materials Project. Materials Data on La2PBr2 by Materials Project. United States. doi:https://doi.org/10.17188/1276037
The Materials Project. 2020. "Materials Data on La2PBr2 by Materials Project". United States. doi:https://doi.org/10.17188/1276037. https://www.osti.gov/servlets/purl/1276037. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1276037,
title = {Materials Data on La2PBr2 by Materials Project},
author = {The Materials Project},
abstractNote = {La2PBr2 is MAX Phase-like structured and crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one La2PBr2 sheet oriented in the (0, 0, 1) direction. La+2.50+ is bonded to three equivalent P3- and three equivalent Br1- atoms to form a mixture of corner and edge-sharing LaP3Br3 octahedra. The corner-sharing octahedral tilt angles are 0°. All La–P bond lengths are 2.96 Å. All La–Br bond lengths are 3.10 Å. P3- is bonded to six equivalent La+2.50+ atoms to form edge-sharing PLa6 octahedra. Br1- is bonded in a 3-coordinate geometry to three equivalent La+2.50+ atoms.},
doi = {10.17188/1276037},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}