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Title: Materials Data on MoPt3 by Materials Project

Abstract

Pt3Mo1 crystallizes in the orthorhombic Pmm2 space group. The structure is three-dimensional. Mo6+ is bonded in a distorted q6 geometry to ten Pt2- atoms. There are a spread of Mo–Pt bond distances ranging from 2.74–2.83 Å. There are three inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded to four equivalent Mo6+ and eight Pt2- atoms to form a mixture of edge, corner, and face-sharing PtMo4Pt8 cuboctahedra. There are a spread of Pt–Pt bond distances ranging from 2.76–2.86 Å. In the second Pt2- site, Pt2- is bonded to four equivalent Mo6+ and eight Pt2- atoms to form a mixture of edge, corner, and face-sharing PtMo4Pt8 cuboctahedra. There are two shorter (2.79 Å) and four longer (2.83 Å) Pt–Pt bond lengths. In the third Pt2- site, Pt2- is bonded to two equivalent Mo6+ and ten Pt2- atoms to form a mixture of edge, corner, and face-sharing PtMo2Pt10 cuboctahedra. Both Pt–Pt bond lengths are 2.79 Å.

Authors:
Publication Date:
Other Number(s):
mp-1221420
DOE Contract Number:  
AC02-05CH11231; EDCBEE
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)
Collaborations:
MIT; UC Berkeley; Duke; U Louvain
Subject:
36 MATERIALS SCIENCE
Keywords:
crystal structure; MoPt3; Mo-Pt
OSTI Identifier:
1744583
DOI:
https://doi.org/10.17188/1744583

Citation Formats

The Materials Project. Materials Data on MoPt3 by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1744583.
The Materials Project. Materials Data on MoPt3 by Materials Project. United States. doi:https://doi.org/10.17188/1744583
The Materials Project. 2020. "Materials Data on MoPt3 by Materials Project". United States. doi:https://doi.org/10.17188/1744583. https://www.osti.gov/servlets/purl/1744583. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1744583,
title = {Materials Data on MoPt3 by Materials Project},
author = {The Materials Project},
abstractNote = {Pt3Mo1 crystallizes in the orthorhombic Pmm2 space group. The structure is three-dimensional. Mo6+ is bonded in a distorted q6 geometry to ten Pt2- atoms. There are a spread of Mo–Pt bond distances ranging from 2.74–2.83 Å. There are three inequivalent Pt2- sites. In the first Pt2- site, Pt2- is bonded to four equivalent Mo6+ and eight Pt2- atoms to form a mixture of edge, corner, and face-sharing PtMo4Pt8 cuboctahedra. There are a spread of Pt–Pt bond distances ranging from 2.76–2.86 Å. In the second Pt2- site, Pt2- is bonded to four equivalent Mo6+ and eight Pt2- atoms to form a mixture of edge, corner, and face-sharing PtMo4Pt8 cuboctahedra. There are two shorter (2.79 Å) and four longer (2.83 Å) Pt–Pt bond lengths. In the third Pt2- site, Pt2- is bonded to two equivalent Mo6+ and ten Pt2- atoms to form a mixture of edge, corner, and face-sharing PtMo2Pt10 cuboctahedra. Both Pt–Pt bond lengths are 2.79 Å.},
doi = {10.17188/1744583},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}