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Title: Materials Data on Si5Pt12 by Materials Project

Abstract

Pt12Si5 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent Pt+1.67- sites. In the first Pt+1.67- site, Pt+1.67- is bonded in a 12-coordinate geometry to four Si4+ atoms. There are a spread of Pt–Si bond distances ranging from 2.42–2.85 Å. In the second Pt+1.67- site, Pt+1.67- is bonded in a 2-coordinate geometry to four equivalent Si4+ atoms. There are a spread of Pt–Si bond distances ranging from 2.43–2.86 Å. There are two inequivalent Si4+ sites. In the first Si4+ site, Si4+ is bonded in a 10-coordinate geometry to ten Pt+1.67- atoms. In the second Si4+ site, Si4+ is bonded in a body-centered cubic geometry to eight equivalent Pt+1.67- atoms.

Publication Date:
Other Number(s):
mp-16317
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; Si5Pt12; Pt-Si
OSTI Identifier:
1191772
DOI:
https://doi.org/10.17188/1191772

Citation Formats

The Materials Project. Materials Data on Si5Pt12 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1191772.
The Materials Project. Materials Data on Si5Pt12 by Materials Project. United States. doi:https://doi.org/10.17188/1191772
The Materials Project. 2020. "Materials Data on Si5Pt12 by Materials Project". United States. doi:https://doi.org/10.17188/1191772. https://www.osti.gov/servlets/purl/1191772. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1191772,
title = {Materials Data on Si5Pt12 by Materials Project},
author = {The Materials Project},
abstractNote = {Pt12Si5 crystallizes in the tetragonal I4/m space group. The structure is three-dimensional. there are two inequivalent Pt+1.67- sites. In the first Pt+1.67- site, Pt+1.67- is bonded in a 12-coordinate geometry to four Si4+ atoms. There are a spread of Pt–Si bond distances ranging from 2.42–2.85 Å. In the second Pt+1.67- site, Pt+1.67- is bonded in a 2-coordinate geometry to four equivalent Si4+ atoms. There are a spread of Pt–Si bond distances ranging from 2.43–2.86 Å. There are two inequivalent Si4+ sites. In the first Si4+ site, Si4+ is bonded in a 10-coordinate geometry to ten Pt+1.67- atoms. In the second Si4+ site, Si4+ is bonded in a body-centered cubic geometry to eight equivalent Pt+1.67- atoms.},
doi = {10.17188/1191772},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}