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Title: Materials Data on TmClO by Materials Project

Abstract

TmOCl crystallizes in the orthorhombic Pmmn space group. The structure is two-dimensional and consists of one TmOCl sheet oriented in the (0, 0, 1) direction. Tm3+ is bonded to four equivalent O2- and two equivalent Cl1- atoms to form a mixture of distorted corner and edge-sharing TmCl2O4 octahedra. The corner-sharing octahedral tilt angles are 40°. There are two shorter (2.21 Å) and two longer (2.27 Å) Tm–O bond lengths. Both Tm–Cl bond lengths are 2.64 Å. O2- is bonded to four equivalent Tm3+ atoms to form a mixture of corner and edge-sharing OTm4 tetrahedra. Cl1- is bonded in an L-shaped geometry to two equivalent Tm3+ atoms.

Authors:
Publication Date:
Other Number(s):
mp-754113
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; TmClO; Cl-O-Tm
OSTI Identifier:
1289250
DOI:
https://doi.org/10.17188/1289250

Citation Formats

The Materials Project. Materials Data on TmClO by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1289250.
The Materials Project. Materials Data on TmClO by Materials Project. United States. doi:https://doi.org/10.17188/1289250
The Materials Project. 2020. "Materials Data on TmClO by Materials Project". United States. doi:https://doi.org/10.17188/1289250. https://www.osti.gov/servlets/purl/1289250. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1289250,
title = {Materials Data on TmClO by Materials Project},
author = {The Materials Project},
abstractNote = {TmOCl crystallizes in the orthorhombic Pmmn space group. The structure is two-dimensional and consists of one TmOCl sheet oriented in the (0, 0, 1) direction. Tm3+ is bonded to four equivalent O2- and two equivalent Cl1- atoms to form a mixture of distorted corner and edge-sharing TmCl2O4 octahedra. The corner-sharing octahedral tilt angles are 40°. There are two shorter (2.21 Å) and two longer (2.27 Å) Tm–O bond lengths. Both Tm–Cl bond lengths are 2.64 Å. O2- is bonded to four equivalent Tm3+ atoms to form a mixture of corner and edge-sharing OTm4 tetrahedra. Cl1- is bonded in an L-shaped geometry to two equivalent Tm3+ atoms.},
doi = {10.17188/1289250},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}