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Title: Materials Data on Pd(SeBr3)2 by Materials Project

Abstract

Pd(SeBr3)2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one Pd(SeBr3)2 ribbon oriented in the (1, 0, 0) direction. Pd4+ is bonded in a distorted square co-planar geometry to two equivalent Se2- and two equivalent Br atoms. Both Pd–Se bond lengths are 2.44 Å. Both Pd–Br bond lengths are 2.47 Å. Se2- is bonded in a 5-coordinate geometry to one Pd4+ and four Br atoms. There are a spread of Se–Br bond distances ranging from 2.37–3.14 Å. There are three inequivalent Br sites. In the first Br site, Br is bonded in a 1-coordinate geometry to one Pd4+ and two equivalent Se2- atoms. In the second Br site, Br is bonded in a single-bond geometry to one Se2- atom. In the third Br site, Br is bonded in a single-bond geometry to one Se2- atom.

Publication Date:
Other Number(s):
mp-29496
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; Pd(SeBr3)2; Br-Pd-Se
OSTI Identifier:
1203970
DOI:
https://doi.org/10.17188/1203970

Citation Formats

The Materials Project. Materials Data on Pd(SeBr3)2 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1203970.
The Materials Project. Materials Data on Pd(SeBr3)2 by Materials Project. United States. doi:https://doi.org/10.17188/1203970
The Materials Project. 2020. "Materials Data on Pd(SeBr3)2 by Materials Project". United States. doi:https://doi.org/10.17188/1203970. https://www.osti.gov/servlets/purl/1203970. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1203970,
title = {Materials Data on Pd(SeBr3)2 by Materials Project},
author = {The Materials Project},
abstractNote = {Pd(SeBr3)2 crystallizes in the triclinic P-1 space group. The structure is one-dimensional and consists of one Pd(SeBr3)2 ribbon oriented in the (1, 0, 0) direction. Pd4+ is bonded in a distorted square co-planar geometry to two equivalent Se2- and two equivalent Br atoms. Both Pd–Se bond lengths are 2.44 Å. Both Pd–Br bond lengths are 2.47 Å. Se2- is bonded in a 5-coordinate geometry to one Pd4+ and four Br atoms. There are a spread of Se–Br bond distances ranging from 2.37–3.14 Å. There are three inequivalent Br sites. In the first Br site, Br is bonded in a 1-coordinate geometry to one Pd4+ and two equivalent Se2- atoms. In the second Br site, Br is bonded in a single-bond geometry to one Se2- atom. In the third Br site, Br is bonded in a single-bond geometry to one Se2- atom.},
doi = {10.17188/1203970},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}