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Title: Materials Data on Ho7PtI12 by Materials Project

Abstract

Ho7PtI12 is trigonal omega-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded to one Pt and five I atoms to form a mixture of distorted corner and edge-sharing HoPtI5 octahedra. The corner-sharing octahedra tilt angles range from 0–7°. The Ho–Pt bond length is 2.71 Å. There are a spread of Ho–I bond distances ranging from 3.11–3.33 Å. In the second Ho site, Ho is bonded to six equivalent I atoms to form edge-sharing HoI6 octahedra. All Ho–I bond lengths are 3.07 Å. Pt is bonded in an octahedral geometry to six equivalent Ho atoms. There are two inequivalent I sites. In the first I site, I is bonded in a distorted T-shaped geometry to three Ho atoms. In the second I site, I is bonded in a distorted T-shaped geometry to three equivalent Ho atoms.

Publication Date:
Other Number(s):
mp-1188549
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; Ho7PtI12; Ho-I-Pt
OSTI Identifier:
1685848
DOI:
https://doi.org/10.17188/1685848

Citation Formats

The Materials Project. Materials Data on Ho7PtI12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1685848.
The Materials Project. Materials Data on Ho7PtI12 by Materials Project. United States. doi:https://doi.org/10.17188/1685848
The Materials Project. 2020. "Materials Data on Ho7PtI12 by Materials Project". United States. doi:https://doi.org/10.17188/1685848. https://www.osti.gov/servlets/purl/1685848. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1685848,
title = {Materials Data on Ho7PtI12 by Materials Project},
author = {The Materials Project},
abstractNote = {Ho7PtI12 is trigonal omega-derived structured and crystallizes in the trigonal R-3 space group. The structure is three-dimensional. there are two inequivalent Ho sites. In the first Ho site, Ho is bonded to one Pt and five I atoms to form a mixture of distorted corner and edge-sharing HoPtI5 octahedra. The corner-sharing octahedra tilt angles range from 0–7°. The Ho–Pt bond length is 2.71 Å. There are a spread of Ho–I bond distances ranging from 3.11–3.33 Å. In the second Ho site, Ho is bonded to six equivalent I atoms to form edge-sharing HoI6 octahedra. All Ho–I bond lengths are 3.07 Å. Pt is bonded in an octahedral geometry to six equivalent Ho atoms. There are two inequivalent I sites. In the first I site, I is bonded in a distorted T-shaped geometry to three Ho atoms. In the second I site, I is bonded in a distorted T-shaped geometry to three equivalent Ho atoms.},
doi = {10.17188/1685848},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}