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Title: Materials Data on Tl9Pd13 by Materials Project

Abstract

Pd13Tl9 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are four inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted linear geometry to six equivalent Pd and eight Tl atoms. All Pd–Pd bond lengths are 2.91 Å. There are two shorter (2.89 Å) and six longer (3.37 Å) Pd–Tl bond lengths. In the second Pd site, Pd is bonded in a 12-coordinate geometry to six Tl atoms. There are four shorter (2.85 Å) and two longer (3.02 Å) Pd–Tl bond lengths. In the third Pd site, Pd is bonded in a 12-coordinate geometry to six Tl atoms. There are four shorter (2.87 Å) and two longer (3.01 Å) Pd–Tl bond lengths. In the fourth Pd site, Pd is bonded in a 6-coordinate geometry to one Pd and six Tl atoms. There are a spread of Pd–Tl bond distances ranging from 2.76–2.97 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a distorted body-centered cubic geometry to eight Pd atoms. In the second Tl site, Tl is bonded in a 9-coordinate geometry to nine Pd atoms. In the third Tl site, Tl is bonded inmore » a 8-coordinate geometry to nine Pd atoms.« less

Publication Date:
Other Number(s):
mp-1297
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; Tl9Pd13; Pd-Tl
OSTI Identifier:
1189298
DOI:
https://doi.org/10.17188/1189298

Citation Formats

The Materials Project. Materials Data on Tl9Pd13 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1189298.
The Materials Project. Materials Data on Tl9Pd13 by Materials Project. United States. doi:https://doi.org/10.17188/1189298
The Materials Project. 2020. "Materials Data on Tl9Pd13 by Materials Project". United States. doi:https://doi.org/10.17188/1189298. https://www.osti.gov/servlets/purl/1189298. Pub date:Sat Jul 18 00:00:00 EDT 2020
@article{osti_1189298,
title = {Materials Data on Tl9Pd13 by Materials Project},
author = {The Materials Project},
abstractNote = {Pd13Tl9 crystallizes in the trigonal P-3m1 space group. The structure is three-dimensional. there are four inequivalent Pd sites. In the first Pd site, Pd is bonded in a distorted linear geometry to six equivalent Pd and eight Tl atoms. All Pd–Pd bond lengths are 2.91 Å. There are two shorter (2.89 Å) and six longer (3.37 Å) Pd–Tl bond lengths. In the second Pd site, Pd is bonded in a 12-coordinate geometry to six Tl atoms. There are four shorter (2.85 Å) and two longer (3.02 Å) Pd–Tl bond lengths. In the third Pd site, Pd is bonded in a 12-coordinate geometry to six Tl atoms. There are four shorter (2.87 Å) and two longer (3.01 Å) Pd–Tl bond lengths. In the fourth Pd site, Pd is bonded in a 6-coordinate geometry to one Pd and six Tl atoms. There are a spread of Pd–Tl bond distances ranging from 2.76–2.97 Å. There are three inequivalent Tl sites. In the first Tl site, Tl is bonded in a distorted body-centered cubic geometry to eight Pd atoms. In the second Tl site, Tl is bonded in a 9-coordinate geometry to nine Pd atoms. In the third Tl site, Tl is bonded in a 8-coordinate geometry to nine Pd atoms.},
doi = {10.17188/1189298},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}