skip to main content
DOE Data Explorer title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Materials Data on Si3O by Materials Project

Abstract

Si3O crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Si sites. In the first Si site, Si is bonded in a single-bond geometry to two equivalent Si and one O atom. Both Si–Si bond lengths are 2.49 Å. The Si–O bond length is 1.61 Å. In the second Si site, Si is bonded in a single-bond geometry to two equivalent Si and one O atom. There are one shorter (2.46 Å) and one longer (2.49 Å) Si–Si bond lengths. The Si–O bond length is 1.64 Å. In the third Si site, Si is bonded to four Si atoms to form corner-sharing SiSi4 tetrahedra. There are two inequivalent O sites. In the first O site, O is bonded in a linear geometry to two equivalent Si atoms. In the second O site, O is bonded in a linear geometry to two equivalent Si atoms.

Authors:
Contributors:
Researcher:
Publication Date:
Other Number(s):
mp-32566
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; Si3O; O-Si
OSTI Identifier:
1206309
DOI:
10.17188/1206309

Citation Formats

Persson, Kristin, and Project, Materials. Materials Data on Si3O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1206309.
Persson, Kristin, & Project, Materials. Materials Data on Si3O by Materials Project. United States. doi:10.17188/1206309.
Persson, Kristin, and Project, Materials. 2020. "Materials Data on Si3O by Materials Project". United States. doi:10.17188/1206309. https://www.osti.gov/servlets/purl/1206309. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1206309,
title = {Materials Data on Si3O by Materials Project},
author = {Persson, Kristin and Project, Materials},
abstractNote = {Si3O crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Si sites. In the first Si site, Si is bonded in a single-bond geometry to two equivalent Si and one O atom. Both Si–Si bond lengths are 2.49 Å. The Si–O bond length is 1.61 Å. In the second Si site, Si is bonded in a single-bond geometry to two equivalent Si and one O atom. There are one shorter (2.46 Å) and one longer (2.49 Å) Si–Si bond lengths. The Si–O bond length is 1.64 Å. In the third Si site, Si is bonded to four Si atoms to form corner-sharing SiSi4 tetrahedra. There are two inequivalent O sites. In the first O site, O is bonded in a linear geometry to two equivalent Si atoms. In the second O site, O is bonded in a linear geometry to two equivalent Si atoms.},
doi = {10.17188/1206309},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}

Dataset:

Save / Share: