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Title: Materials Data on Ta2Cl5 by Materials Project

Abstract

Ta2Cl5 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Ta is bonded to five Cl atoms to form distorted corner-sharing TaCl5 square pyramids. There are a spread of Ta–Cl bond distances ranging from 2.45–2.66 Å. There are three inequivalent Cl sites. In the first Cl site, Cl is bonded in a 2-coordinate geometry to two equivalent Ta atoms. In the second Cl site, Cl is bonded in a 2-coordinate geometry to two equivalent Ta atoms. In the third Cl site, Cl is bonded in a bent 150 degrees geometry to two equivalent Ta atoms.

Authors:
Publication Date:
Other Number(s):
mp-23274
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; Ta2Cl5; Cl-Ta
OSTI Identifier:
1199384
DOI:
https://doi.org/10.17188/1199384

Citation Formats

The Materials Project. Materials Data on Ta2Cl5 by Materials Project. United States: N. p., 2014. Web. doi:10.17188/1199384.
The Materials Project. Materials Data on Ta2Cl5 by Materials Project. United States. doi:https://doi.org/10.17188/1199384
The Materials Project. 2014. "Materials Data on Ta2Cl5 by Materials Project". United States. doi:https://doi.org/10.17188/1199384. https://www.osti.gov/servlets/purl/1199384. Pub date:Fri Mar 21 00:00:00 EDT 2014
@article{osti_1199384,
title = {Materials Data on Ta2Cl5 by Materials Project},
author = {The Materials Project},
abstractNote = {Ta2Cl5 crystallizes in the cubic Ia-3d space group. The structure is three-dimensional. Ta is bonded to five Cl atoms to form distorted corner-sharing TaCl5 square pyramids. There are a spread of Ta–Cl bond distances ranging from 2.45–2.66 Å. There are three inequivalent Cl sites. In the first Cl site, Cl is bonded in a 2-coordinate geometry to two equivalent Ta atoms. In the second Cl site, Cl is bonded in a 2-coordinate geometry to two equivalent Ta atoms. In the third Cl site, Cl is bonded in a bent 150 degrees geometry to two equivalent Ta atoms.},
doi = {10.17188/1199384},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2014},
month = {3}
}