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Title: Materials Data on Nb5Pt3O by Materials Project

Abstract

Nb5Pt3O crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Nb sites. In the first Nb site, Nb is bonded in a 7-coordinate geometry to five equivalent Pt and two equivalent O atoms. There are a spread of Nb–Pt bond distances ranging from 2.84–2.89 Å. Both Nb–O bond lengths are 2.30 Å. In the second Nb site, Nb is bonded in a 8-coordinate geometry to two equivalent Nb and six equivalent Pt atoms. Both Nb–Nb bond lengths are 2.54 Å. All Nb–Pt bond lengths are 2.76 Å. Pt is bonded in a 9-coordinate geometry to nine Nb atoms. O is bonded to six equivalent Nb atoms to form face-sharing ONb6 octahedra.

Publication Date:
Other Number(s):
mp-17525
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; Nb5Pt3O; Nb-O-Pt
OSTI Identifier:
1192555
DOI:
https://doi.org/10.17188/1192555

Citation Formats

The Materials Project. Materials Data on Nb5Pt3O by Materials Project. United States: N. p., 2020. Web. doi:10.17188/1192555.
The Materials Project. Materials Data on Nb5Pt3O by Materials Project. United States. doi:https://doi.org/10.17188/1192555
The Materials Project. 2020. "Materials Data on Nb5Pt3O by Materials Project". United States. doi:https://doi.org/10.17188/1192555. https://www.osti.gov/servlets/purl/1192555. Pub date:Fri Jul 17 00:00:00 EDT 2020
@article{osti_1192555,
title = {Materials Data on Nb5Pt3O by Materials Project},
author = {The Materials Project},
abstractNote = {Nb5Pt3O crystallizes in the hexagonal P6_3/mcm space group. The structure is three-dimensional. there are two inequivalent Nb sites. In the first Nb site, Nb is bonded in a 7-coordinate geometry to five equivalent Pt and two equivalent O atoms. There are a spread of Nb–Pt bond distances ranging from 2.84–2.89 Å. Both Nb–O bond lengths are 2.30 Å. In the second Nb site, Nb is bonded in a 8-coordinate geometry to two equivalent Nb and six equivalent Pt atoms. Both Nb–Nb bond lengths are 2.54 Å. All Nb–Pt bond lengths are 2.76 Å. Pt is bonded in a 9-coordinate geometry to nine Nb atoms. O is bonded to six equivalent Nb atoms to form face-sharing ONb6 octahedra.},
doi = {10.17188/1192555},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}