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Title: Materials Data on CdWO4 by Materials Project

Abstract

CdWO4 is zeta iron carbide-derived structured and crystallizes in the monoclinic P2/c space group. The structure is three-dimensional. W6+ is bonded to six O2- atoms to form distorted WO6 octahedra that share corners with eight equivalent CdO6 octahedra and edges with two equivalent WO6 octahedra. The corner-sharing octahedra tilt angles range from 40–57°. There are a spread of W–O bond distances ranging from 1.83–2.14 Å. Cd2+ is bonded to six O2- atoms to form CdO6 octahedra that share corners with eight equivalent WO6 octahedra and edges with two equivalent CdO6 octahedra. The corner-sharing octahedra tilt angles range from 40–57°. There are a spread of Cd–O bond distances ranging from 2.27–2.44 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent W6+ and one Cd2+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one W6+ and two equivalent Cd2+ atoms.

Publication Date:
Other Number(s):
mp-19387
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; CdWO4; Cd-O-W
OSTI Identifier:
1194394
DOI:
https://doi.org/10.17188/1194394

Citation Formats

The Materials Project. Materials Data on CdWO4 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1194394.
The Materials Project. Materials Data on CdWO4 by Materials Project. United States. doi:https://doi.org/10.17188/1194394
The Materials Project. 2020. "Materials Data on CdWO4 by Materials Project". United States. doi:https://doi.org/10.17188/1194394. https://www.osti.gov/servlets/purl/1194394. Pub date:Tue Jul 14 00:00:00 EDT 2020
@article{osti_1194394,
title = {Materials Data on CdWO4 by Materials Project},
author = {The Materials Project},
abstractNote = {CdWO4 is zeta iron carbide-derived structured and crystallizes in the monoclinic P2/c space group. The structure is three-dimensional. W6+ is bonded to six O2- atoms to form distorted WO6 octahedra that share corners with eight equivalent CdO6 octahedra and edges with two equivalent WO6 octahedra. The corner-sharing octahedra tilt angles range from 40–57°. There are a spread of W–O bond distances ranging from 1.83–2.14 Å. Cd2+ is bonded to six O2- atoms to form CdO6 octahedra that share corners with eight equivalent WO6 octahedra and edges with two equivalent CdO6 octahedra. The corner-sharing octahedra tilt angles range from 40–57°. There are a spread of Cd–O bond distances ranging from 2.27–2.44 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a distorted trigonal planar geometry to two equivalent W6+ and one Cd2+ atom. In the second O2- site, O2- is bonded in a 3-coordinate geometry to one W6+ and two equivalent Cd2+ atoms.},
doi = {10.17188/1194394},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}