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Title: Materials Data on CuP4Se3Cl by Materials Project

Abstract

CuClP4Se3 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of four tetraphosphorous triselenide molecules and two CuCl ribbons oriented in the (1, 0, 0) direction. In each CuCl ribbon, Cu1+ is bonded in a water-like geometry to two equivalent Cl1- atoms. There are one shorter (2.31 Å) and one longer (2.37 Å) Cu–Cl bond lengths. Cl1- is bonded in a bent 120 degrees geometry to two equivalent Cu1+ atoms.

Publication Date:
Other Number(s):
mp-1196912
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; CuP4Se3Cl; Cl-Cu-P-Se
OSTI Identifier:
1723118
DOI:
https://doi.org/10.17188/1723118

Citation Formats

The Materials Project. Materials Data on CuP4Se3Cl by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1723118.
The Materials Project. Materials Data on CuP4Se3Cl by Materials Project. United States. doi:https://doi.org/10.17188/1723118
The Materials Project. 2020. "Materials Data on CuP4Se3Cl by Materials Project". United States. doi:https://doi.org/10.17188/1723118. https://www.osti.gov/servlets/purl/1723118. Pub date:Sun May 03 00:00:00 EDT 2020
@article{osti_1723118,
title = {Materials Data on CuP4Se3Cl by Materials Project},
author = {The Materials Project},
abstractNote = {CuClP4Se3 crystallizes in the monoclinic P2_1/c space group. The structure is one-dimensional and consists of four tetraphosphorous triselenide molecules and two CuCl ribbons oriented in the (1, 0, 0) direction. In each CuCl ribbon, Cu1+ is bonded in a water-like geometry to two equivalent Cl1- atoms. There are one shorter (2.31 Å) and one longer (2.37 Å) Cu–Cl bond lengths. Cl1- is bonded in a bent 120 degrees geometry to two equivalent Cu1+ atoms.},
doi = {10.17188/1723118},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}