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Title: Materials Data on GeNCl3 by Materials Project

Abstract

GeNCl3 crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of two GeNCl3 ribbons oriented in the (0, 1, 0) direction. Ge4+ is bonded to four Cl1- atoms to form corner-sharing GeCl4 tetrahedra. There are a spread of Ge–Cl bond distances ranging from 2.17–2.43 Å. N1- is bonded in a 4-coordinate geometry to two equivalent Cl1- atoms. Both N–Cl bond lengths are 3.66 Å. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Ge4+ and one N1- atom. In the second Cl1- site, Cl1- is bonded in a linear geometry to two equivalent Ge4+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-1188940
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; GeNCl3; Cl-Ge-N
OSTI Identifier:
1698628
DOI:
https://doi.org/10.17188/1698628

Citation Formats

The Materials Project. Materials Data on GeNCl3 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1698628.
The Materials Project. Materials Data on GeNCl3 by Materials Project. United States. doi:https://doi.org/10.17188/1698628
The Materials Project. 2019. "Materials Data on GeNCl3 by Materials Project". United States. doi:https://doi.org/10.17188/1698628. https://www.osti.gov/servlets/purl/1698628. Pub date:Fri Jan 11 00:00:00 EST 2019
@article{osti_1698628,
title = {Materials Data on GeNCl3 by Materials Project},
author = {The Materials Project},
abstractNote = {GeNCl3 crystallizes in the orthorhombic Pnma space group. The structure is one-dimensional and consists of two GeNCl3 ribbons oriented in the (0, 1, 0) direction. Ge4+ is bonded to four Cl1- atoms to form corner-sharing GeCl4 tetrahedra. There are a spread of Ge–Cl bond distances ranging from 2.17–2.43 Å. N1- is bonded in a 4-coordinate geometry to two equivalent Cl1- atoms. Both N–Cl bond lengths are 3.66 Å. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a single-bond geometry to one Ge4+ and one N1- atom. In the second Cl1- site, Cl1- is bonded in a linear geometry to two equivalent Ge4+ atoms.},
doi = {10.17188/1698628},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}