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Title: Materials Data on YB2C by Materials Project

Abstract

YB2C crystallizes in the tetragonal P4_2/mbc space group. The structure is three-dimensional. Y3+ is bonded in a 4-coordinate geometry to four equivalent C3- atoms. There are two shorter (2.61 Å) and two longer (2.62 Å) Y–C bond lengths. There are two inequivalent B sites. In the first B site, B is bonded in a distorted water-like geometry to two equivalent C3- atoms. Both B–C bond lengths are 1.63 Å. In the second B site, B is bonded in a distorted single-bond geometry to one C3- atom. The B–C bond length is 1.60 Å. C3- is bonded in a 3-coordinate geometry to four equivalent Y3+ and three B atoms.

Authors:
Publication Date:
Other Number(s):
mp-9880
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; YB2C; B-C-Y
OSTI Identifier:
1316766
DOI:
https://doi.org/10.17188/1316766

Citation Formats

The Materials Project. Materials Data on YB2C by Materials Project. United States: N. p., 2017. Web. doi:10.17188/1316766.
The Materials Project. Materials Data on YB2C by Materials Project. United States. doi:https://doi.org/10.17188/1316766
The Materials Project. 2017. "Materials Data on YB2C by Materials Project". United States. doi:https://doi.org/10.17188/1316766. https://www.osti.gov/servlets/purl/1316766. Pub date:Wed May 10 00:00:00 EDT 2017
@article{osti_1316766,
title = {Materials Data on YB2C by Materials Project},
author = {The Materials Project},
abstractNote = {YB2C crystallizes in the tetragonal P4_2/mbc space group. The structure is three-dimensional. Y3+ is bonded in a 4-coordinate geometry to four equivalent C3- atoms. There are two shorter (2.61 Å) and two longer (2.62 Å) Y–C bond lengths. There are two inequivalent B sites. In the first B site, B is bonded in a distorted water-like geometry to two equivalent C3- atoms. Both B–C bond lengths are 1.63 Å. In the second B site, B is bonded in a distorted single-bond geometry to one C3- atom. The B–C bond length is 1.60 Å. C3- is bonded in a 3-coordinate geometry to four equivalent Y3+ and three B atoms.},
doi = {10.17188/1316766},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}