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Title: Materials Data on PdSeS by Materials Project

Abstract

PdSSe crystallizes in the orthorhombic P2_12_12_1 space group. The structure is two-dimensional and consists of two PdSSe sheets oriented in the (0, 0, 1) direction. Pd4+ is bonded in a square co-planar geometry to two equivalent Se2- and two equivalent S2- atoms. Both Pd–Se bond lengths are 2.46 Å. There are one shorter (2.35 Å) and one longer (2.36 Å) Pd–S bond lengths. Se2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Pd4+ and one S2- atom. The Se–S bond length is 2.27 Å. S2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Pd4+ and one Se2- atom.

Authors:
Publication Date:
Other Number(s):
mp-1219871
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; PdSeS; Pd-S-Se
OSTI Identifier:
1684115
DOI:
https://doi.org/10.17188/1684115

Citation Formats

The Materials Project. Materials Data on PdSeS by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1684115.
The Materials Project. Materials Data on PdSeS by Materials Project. United States. doi:https://doi.org/10.17188/1684115
The Materials Project. 2020. "Materials Data on PdSeS by Materials Project". United States. doi:https://doi.org/10.17188/1684115. https://www.osti.gov/servlets/purl/1684115. Pub date:Mon May 04 00:00:00 EDT 2020
@article{osti_1684115,
title = {Materials Data on PdSeS by Materials Project},
author = {The Materials Project},
abstractNote = {PdSSe crystallizes in the orthorhombic P2_12_12_1 space group. The structure is two-dimensional and consists of two PdSSe sheets oriented in the (0, 0, 1) direction. Pd4+ is bonded in a square co-planar geometry to two equivalent Se2- and two equivalent S2- atoms. Both Pd–Se bond lengths are 2.46 Å. There are one shorter (2.35 Å) and one longer (2.36 Å) Pd–S bond lengths. Se2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Pd4+ and one S2- atom. The Se–S bond length is 2.27 Å. S2- is bonded in a distorted trigonal non-coplanar geometry to two equivalent Pd4+ and one Se2- atom.},
doi = {10.17188/1684115},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}