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Title: Materials Data on Lu4(Al8Pt3)3 by Materials Project

Abstract

Lu4(Pt3Al8)3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded in a 9-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Lu–Pt bond distances ranging from 3.27–3.55 Å. There are a spread of Lu–Al bond distances ranging from 3.05–3.22 Å. In the second Lu site, Lu is bonded in a 9-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Lu–Pt bond distances ranging from 3.26–3.55 Å. There are a spread of Lu–Al bond distances ranging from 3.06–3.22 Å. There are five inequivalent Pt sites. In the first Pt site, Pt is bonded in a 8-coordinate geometry to two Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.51–2.75 Å. In the second Pt site, Pt is bonded in a 8-coordinate geometry to two Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.51–2.75 Å. In the third Pt site, Pt is bonded in a 8-coordinate geometry to four Lu and eight Al atoms. There are a spread of Pt–Al bond distances rangingmore » from 2.57–2.61 Å. In the fourth Pt site, Pt is bonded in a 10-coordinate geometry to two Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.51–2.76 Å. In the fifth Pt site, Pt is bonded in a 8-coordinate geometry to four Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.54–2.63 Å. There are twelve inequivalent Al sites. In the first Al site, Al is bonded in a 3-coordinate geometry to three Lu and three Pt atoms. In the second Al site, Al is bonded to four Pt atoms to form distorted AlPt4 tetrahedra that share corners with six AlLuPt4 tetrahedra and edges with three AlPt4 tetrahedra. In the third Al site, Al is bonded to one Lu and four Pt atoms to form a mixture of distorted edge and corner-sharing AlLuPt4 tetrahedra. In the fourth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the fifth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the sixth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the seventh Al site, Al is bonded in a 3-coordinate geometry to three Lu and three Pt atoms. In the eighth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the ninth Al site, Al is bonded to one Lu and four Pt atoms to form a mixture of distorted edge and corner-sharing AlLuPt4 tetrahedra. In the tenth Al site, Al is bonded in a 2-coordinate geometry to two Lu and two Pt atoms. In the eleventh Al site, Al is bonded in a 2-coordinate geometry to two Lu and two Pt atoms. In the twelfth Al site, Al is bonded in a 2-coordinate geometry to two Lu and two Pt atoms.« less

Authors:
Publication Date:
Other Number(s):
mp-1210587
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; Lu4(Al8Pt3)3; Al-Lu-Pt
OSTI Identifier:
1683758
DOI:
https://doi.org/10.17188/1683758

Citation Formats

The Materials Project. Materials Data on Lu4(Al8Pt3)3 by Materials Project. United States: N. p., 2019. Web. doi:10.17188/1683758.
The Materials Project. Materials Data on Lu4(Al8Pt3)3 by Materials Project. United States. doi:https://doi.org/10.17188/1683758
The Materials Project. 2019. "Materials Data on Lu4(Al8Pt3)3 by Materials Project". United States. doi:https://doi.org/10.17188/1683758. https://www.osti.gov/servlets/purl/1683758. Pub date:Sat Jan 12 00:00:00 EST 2019
@article{osti_1683758,
title = {Materials Data on Lu4(Al8Pt3)3 by Materials Project},
author = {The Materials Project},
abstractNote = {Lu4(Pt3Al8)3 crystallizes in the triclinic P-1 space group. The structure is three-dimensional. there are two inequivalent Lu sites. In the first Lu site, Lu is bonded in a 9-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Lu–Pt bond distances ranging from 3.27–3.55 Å. There are a spread of Lu–Al bond distances ranging from 3.05–3.22 Å. In the second Lu site, Lu is bonded in a 9-coordinate geometry to six Pt and eleven Al atoms. There are a spread of Lu–Pt bond distances ranging from 3.26–3.55 Å. There are a spread of Lu–Al bond distances ranging from 3.06–3.22 Å. There are five inequivalent Pt sites. In the first Pt site, Pt is bonded in a 8-coordinate geometry to two Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.51–2.75 Å. In the second Pt site, Pt is bonded in a 8-coordinate geometry to two Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.51–2.75 Å. In the third Pt site, Pt is bonded in a 8-coordinate geometry to four Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.57–2.61 Å. In the fourth Pt site, Pt is bonded in a 10-coordinate geometry to two Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.51–2.76 Å. In the fifth Pt site, Pt is bonded in a 8-coordinate geometry to four Lu and eight Al atoms. There are a spread of Pt–Al bond distances ranging from 2.54–2.63 Å. There are twelve inequivalent Al sites. In the first Al site, Al is bonded in a 3-coordinate geometry to three Lu and three Pt atoms. In the second Al site, Al is bonded to four Pt atoms to form distorted AlPt4 tetrahedra that share corners with six AlLuPt4 tetrahedra and edges with three AlPt4 tetrahedra. In the third Al site, Al is bonded to one Lu and four Pt atoms to form a mixture of distorted edge and corner-sharing AlLuPt4 tetrahedra. In the fourth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the fifth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the sixth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the seventh Al site, Al is bonded in a 3-coordinate geometry to three Lu and three Pt atoms. In the eighth Al site, Al is bonded in a 3-coordinate geometry to two Lu and three Pt atoms. In the ninth Al site, Al is bonded to one Lu and four Pt atoms to form a mixture of distorted edge and corner-sharing AlLuPt4 tetrahedra. In the tenth Al site, Al is bonded in a 2-coordinate geometry to two Lu and two Pt atoms. In the eleventh Al site, Al is bonded in a 2-coordinate geometry to two Lu and two Pt atoms. In the twelfth Al site, Al is bonded in a 2-coordinate geometry to two Lu and two Pt atoms.},
doi = {10.17188/1683758},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}