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Title: Materials Data on CeP5 by Materials Project

Abstract

CeP5 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Ce3+ is bonded in a 10-coordinate geometry to ten P+0.60- atoms. There are a spread of Ce–P bond distances ranging from 2.86–3.25 Å. There are three inequivalent P+0.60- sites. In the first P+0.60- site, P+0.60- is bonded in a 5-coordinate geometry to three equivalent Ce3+ and two P+0.60- atoms. Both P–P bond lengths are 2.22 Å. In the second P+0.60- site, P+0.60- is bonded in a rectangular see-saw-like geometry to two equivalent Ce3+ and two equivalent P+0.60- atoms. Both P–P bond lengths are 2.22 Å. In the third P+0.60- site, P+0.60- is bonded to one Ce3+ and three P+0.60- atoms to form distorted edge-sharing PCeP3 tetrahedra. The P–P bond length is 2.24 Å.

Publication Date:
Other Number(s):
mp-566
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; CeP5; Ce-P
OSTI Identifier:
1273244
DOI:
10.17188/1273244

Citation Formats

The Materials Project. Materials Data on CeP5 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1273244.
The Materials Project. Materials Data on CeP5 by Materials Project. United States. doi:10.17188/1273244.
The Materials Project. 2020. "Materials Data on CeP5 by Materials Project". United States. doi:10.17188/1273244. https://www.osti.gov/servlets/purl/1273244. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1273244,
title = {Materials Data on CeP5 by Materials Project},
author = {The Materials Project},
abstractNote = {CeP5 crystallizes in the monoclinic P2_1/m space group. The structure is three-dimensional. Ce3+ is bonded in a 10-coordinate geometry to ten P+0.60- atoms. There are a spread of Ce–P bond distances ranging from 2.86–3.25 Å. There are three inequivalent P+0.60- sites. In the first P+0.60- site, P+0.60- is bonded in a 5-coordinate geometry to three equivalent Ce3+ and two P+0.60- atoms. Both P–P bond lengths are 2.22 Å. In the second P+0.60- site, P+0.60- is bonded in a rectangular see-saw-like geometry to two equivalent Ce3+ and two equivalent P+0.60- atoms. Both P–P bond lengths are 2.22 Å. In the third P+0.60- site, P+0.60- is bonded to one Ce3+ and three P+0.60- atoms to form distorted edge-sharing PCeP3 tetrahedra. The P–P bond length is 2.24 Å.},
doi = {10.17188/1273244},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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