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Title: Materials Data on CdP2 by Materials Project

Abstract

CdP2 crystallizes in the orthorhombic Pna2_1 space group. The structure is three-dimensional. Cd2+ is bonded to four P1- atoms to form CdP4 tetrahedra that share corners with four equivalent CdP4 tetrahedra and corners with eight PCd2P2 tetrahedra. There are a spread of Cd–P bond distances ranging from 2.58–2.64 Å. There are two inequivalent P1- sites. In the first P1- site, P1- is bonded to two equivalent Cd2+ and two equivalent P1- atoms to form PCd2P2 tetrahedra that share corners with four equivalent CdP4 tetrahedra and corners with eight PCd2P2 tetrahedra. There are one shorter (2.18 Å) and one longer (2.23 Å) P–P bond lengths. In the second P1- site, P1- is bonded to two equivalent Cd2+ and two equivalent P1- atoms to form PCd2P2 tetrahedra that share corners with four equivalent CdP4 tetrahedra and corners with eight PCd2P2 tetrahedra.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-402
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; CdP2; Cd-P
OSTI Identifier:
1207767
DOI:
10.17188/1207767

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on CdP2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1207767.
Persson, Kristin, & Project, Materials. Materials Data on CdP2 by Materials Project. United States. doi:10.17188/1207767.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on CdP2 by Materials Project". United States. doi:10.17188/1207767. https://www.osti.gov/servlets/purl/1207767. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1207767,
title = {Materials Data on CdP2 by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {CdP2 crystallizes in the orthorhombic Pna2_1 space group. The structure is three-dimensional. Cd2+ is bonded to four P1- atoms to form CdP4 tetrahedra that share corners with four equivalent CdP4 tetrahedra and corners with eight PCd2P2 tetrahedra. There are a spread of Cd–P bond distances ranging from 2.58–2.64 Å. There are two inequivalent P1- sites. In the first P1- site, P1- is bonded to two equivalent Cd2+ and two equivalent P1- atoms to form PCd2P2 tetrahedra that share corners with four equivalent CdP4 tetrahedra and corners with eight PCd2P2 tetrahedra. There are one shorter (2.18 Å) and one longer (2.23 Å) P–P bond lengths. In the second P1- site, P1- is bonded to two equivalent Cd2+ and two equivalent P1- atoms to form PCd2P2 tetrahedra that share corners with four equivalent CdP4 tetrahedra and corners with eight PCd2P2 tetrahedra.},
doi = {10.17188/1207767},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}

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