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Title: Materials Data on CdAsP by Materials Project

Abstract

CdAsP crystallizes in the orthorhombic I2_12_12_1 space group. The structure is three-dimensional. Cd2+ is bonded to two equivalent As1- and two equivalent P1- atoms to form distorted CdAs2P2 trigonal pyramids that share corners with four equivalent PCd2As2 tetrahedra and corners with four equivalent CdAs2P2 trigonal pyramids. Both Cd–As bond lengths are 2.77 Å. Both Cd–P bond lengths are 2.65 Å. As1- is bonded in a distorted see-saw-like geometry to two equivalent Cd2+ and two equivalent P1- atoms. Both As–P bond lengths are 2.35 Å. P1- is bonded to two equivalent Cd2+ and two equivalent As1- atoms to form distorted PCd2As2 tetrahedra that share corners with four equivalent PCd2As2 tetrahedra and corners with four equivalent CdAs2P2 trigonal pyramids.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-1226754
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; CdAsP; As-Cd-P
OSTI Identifier:
1672317
DOI:
10.17188/1672317

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on CdAsP by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1672317.
Persson, Kristin, & Project, Materials. Materials Data on CdAsP by Materials Project. United States. doi:10.17188/1672317.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on CdAsP by Materials Project". United States. doi:10.17188/1672317. https://www.osti.gov/servlets/purl/1672317. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1672317,
title = {Materials Data on CdAsP by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {CdAsP crystallizes in the orthorhombic I2_12_12_1 space group. The structure is three-dimensional. Cd2+ is bonded to two equivalent As1- and two equivalent P1- atoms to form distorted CdAs2P2 trigonal pyramids that share corners with four equivalent PCd2As2 tetrahedra and corners with four equivalent CdAs2P2 trigonal pyramids. Both Cd–As bond lengths are 2.77 Å. Both Cd–P bond lengths are 2.65 Å. As1- is bonded in a distorted see-saw-like geometry to two equivalent Cd2+ and two equivalent P1- atoms. Both As–P bond lengths are 2.35 Å. P1- is bonded to two equivalent Cd2+ and two equivalent As1- atoms to form distorted PCd2As2 tetrahedra that share corners with four equivalent PCd2As2 tetrahedra and corners with four equivalent CdAs2P2 trigonal pyramids.},
doi = {10.17188/1672317},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}

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