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Title: Materials Data on Yb3Mo by Materials Project

Abstract

Yb3Mo is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are three inequivalent Yb sites. In the first Yb site, Yb is bonded to four Yb and four Mo atoms to form a mixture of distorted face, edge, and corner-sharing YbYb4Mo4 tetrahedra. All Yb–Yb bond lengths are 3.27 Å. All Yb–Mo bond lengths are 3.27 Å. In the second Yb site, Yb is bonded in a 10-coordinate geometry to eight equivalent Yb and six Mo atoms. There are two shorter (3.75 Å) and four longer (3.80 Å) Yb–Mo bond lengths. In the third Yb site, Yb is bonded in a 10-coordinate geometry to eight equivalent Yb and six Mo atoms. There are two shorter (3.75 Å) and four longer (3.80 Å) Yb–Mo bond lengths. There are two inequivalent Mo sites. In the first Mo site, Mo is bonded in a distorted body-centered cubic geometry to fourteen Yb atoms. In the second Mo site, Mo is bonded in a distorted body-centered cubic geometry to fourteen Yb atoms.

Publication Date:
Other Number(s):
mp-1187964
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; Yb3Mo; Mo-Yb
OSTI Identifier:
1757659
DOI:
https://doi.org/10.17188/1757659

Citation Formats

The Materials Project. Materials Data on Yb3Mo by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1757659.
The Materials Project. Materials Data on Yb3Mo by Materials Project. United States. doi:https://doi.org/10.17188/1757659
The Materials Project. 2020. "Materials Data on Yb3Mo by Materials Project". United States. doi:https://doi.org/10.17188/1757659. https://www.osti.gov/servlets/purl/1757659. Pub date:Thu Sep 03 00:00:00 EDT 2020
@article{osti_1757659,
title = {Materials Data on Yb3Mo by Materials Project},
author = {The Materials Project},
abstractNote = {Yb3Mo is alpha bismuth trifluoride structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. there are three inequivalent Yb sites. In the first Yb site, Yb is bonded to four Yb and four Mo atoms to form a mixture of distorted face, edge, and corner-sharing YbYb4Mo4 tetrahedra. All Yb–Yb bond lengths are 3.27 Å. All Yb–Mo bond lengths are 3.27 Å. In the second Yb site, Yb is bonded in a 10-coordinate geometry to eight equivalent Yb and six Mo atoms. There are two shorter (3.75 Å) and four longer (3.80 Å) Yb–Mo bond lengths. In the third Yb site, Yb is bonded in a 10-coordinate geometry to eight equivalent Yb and six Mo atoms. There are two shorter (3.75 Å) and four longer (3.80 Å) Yb–Mo bond lengths. There are two inequivalent Mo sites. In the first Mo site, Mo is bonded in a distorted body-centered cubic geometry to fourteen Yb atoms. In the second Mo site, Mo is bonded in a distorted body-centered cubic geometry to fourteen Yb atoms.},
doi = {10.17188/1757659},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {9}
}