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Title: Materials Data on Te3Pd13 by Materials Project

Abstract

Pd13Te3 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. there are four inequivalent Pd sites. In the first Pd site, Pd is bonded in a 1-coordinate geometry to four Pd and one Te atom. There are one shorter (3.01 Å) and three longer (3.10 Å) Pd–Pd bond lengths. The Pd–Te bond length is 2.58 Å. In the second Pd site, Pd is bonded to ten Pd and four equivalent Te atoms to form distorted corner-sharing PdTe4Pd10 tetrahedra. All Pd–Pd bond lengths are 3.07 Å. All Pd–Te bond lengths are 2.79 Å. In the third Pd site, Pd is bonded in a 2-coordinate geometry to three Pd and two equivalent Te atoms. Both Pd–Pd bond lengths are 2.88 Å. Both Pd–Te bond lengths are 2.71 Å. In the fourth Pd site, Pd is bonded in a 8-coordinate geometry to twelve Pd and two equivalent Te atoms. Both Pd–Te bond lengths are 2.79 Å. There are two inequivalent Te sites. In the first Te site, Te is bonded in a body-centered cubic geometry to eight Pd atoms. In the second Te site, Te is bonded in a body-centered cubic geometry to eight Pd atoms.

Publication Date:
Other Number(s):
mp-638586
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; Te3Pd13; Pd-Te
OSTI Identifier:
1279789
DOI:
https://doi.org/10.17188/1279789

Citation Formats

The Materials Project. Materials Data on Te3Pd13 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1279789.
The Materials Project. Materials Data on Te3Pd13 by Materials Project. United States. doi:https://doi.org/10.17188/1279789
The Materials Project. 2020. "Materials Data on Te3Pd13 by Materials Project". United States. doi:https://doi.org/10.17188/1279789. https://www.osti.gov/servlets/purl/1279789. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1279789,
title = {Materials Data on Te3Pd13 by Materials Project},
author = {The Materials Project},
abstractNote = {Pd13Te3 crystallizes in the cubic Fd-3m space group. The structure is three-dimensional. there are four inequivalent Pd sites. In the first Pd site, Pd is bonded in a 1-coordinate geometry to four Pd and one Te atom. There are one shorter (3.01 Å) and three longer (3.10 Å) Pd–Pd bond lengths. The Pd–Te bond length is 2.58 Å. In the second Pd site, Pd is bonded to ten Pd and four equivalent Te atoms to form distorted corner-sharing PdTe4Pd10 tetrahedra. All Pd–Pd bond lengths are 3.07 Å. All Pd–Te bond lengths are 2.79 Å. In the third Pd site, Pd is bonded in a 2-coordinate geometry to three Pd and two equivalent Te atoms. Both Pd–Pd bond lengths are 2.88 Å. Both Pd–Te bond lengths are 2.71 Å. In the fourth Pd site, Pd is bonded in a 8-coordinate geometry to twelve Pd and two equivalent Te atoms. Both Pd–Te bond lengths are 2.79 Å. There are two inequivalent Te sites. In the first Te site, Te is bonded in a body-centered cubic geometry to eight Pd atoms. In the second Te site, Te is bonded in a body-centered cubic geometry to eight Pd atoms.},
doi = {10.17188/1279789},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}