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Title: Materials Data on SiPt3 by Materials Project

Abstract

Pt3Si crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. there are two inequivalent Pt+1.33+ sites. In the first Pt+1.33+ site, Pt+1.33+ is bonded in a water-like geometry to two equivalent Si4- atoms. Both Pt–Si bond lengths are 2.45 Å. In the second Pt+1.33+ site, Pt+1.33+ is bonded in a square co-planar geometry to four Si4- atoms. All Pt–Si bond lengths are 2.75 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 8-coordinate geometry to eight Pt+1.33+ atoms. In the second Si4- site, Si4- is bonded in a distorted body-centered cubic geometry to eight Pt+1.33+ atoms. All Si–Pt bond lengths are 2.45 Å.

Publication Date:
Other Number(s):
mp-1079269
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; SiPt3; Pt-Si
OSTI Identifier:
1725129
DOI:
https://doi.org/10.17188/1725129

Citation Formats

The Materials Project. Materials Data on SiPt3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1725129.
The Materials Project. Materials Data on SiPt3 by Materials Project. United States. doi:https://doi.org/10.17188/1725129
The Materials Project. 2020. "Materials Data on SiPt3 by Materials Project". United States. doi:https://doi.org/10.17188/1725129. https://www.osti.gov/servlets/purl/1725129. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1725129,
title = {Materials Data on SiPt3 by Materials Project},
author = {The Materials Project},
abstractNote = {Pt3Si crystallizes in the tetragonal P4/mbm space group. The structure is three-dimensional. there are two inequivalent Pt+1.33+ sites. In the first Pt+1.33+ site, Pt+1.33+ is bonded in a water-like geometry to two equivalent Si4- atoms. Both Pt–Si bond lengths are 2.45 Å. In the second Pt+1.33+ site, Pt+1.33+ is bonded in a square co-planar geometry to four Si4- atoms. All Pt–Si bond lengths are 2.75 Å. There are two inequivalent Si4- sites. In the first Si4- site, Si4- is bonded in a 8-coordinate geometry to eight Pt+1.33+ atoms. In the second Si4- site, Si4- is bonded in a distorted body-centered cubic geometry to eight Pt+1.33+ atoms. All Si–Pt bond lengths are 2.45 Å.},
doi = {10.17188/1725129},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}