U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on LaBPt4 by Materials Project
Abstract
LaPt4B crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. there are two inequivalent La3+ sites. In the first La3+ site, La3+ is bonded in a hexagonal planar geometry to six equivalent Pt atoms. All La–Pt bond lengths are 3.20 Å. In the second La3+ site, La3+ is bonded in a 12-coordinate geometry to twelve equivalent Pt and six equivalent B3- atoms. All La–Pt bond lengths are 3.17 Å. All La–B bond lengths are 3.20 Å. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a 12-coordinate geometry to three equivalent La3+ and nine Pt atoms. There are six shorter (2.83 Å) and three longer (3.20 Å) Pt–Pt bond lengths. In the second Pt site, Pt is bonded in a distorted L-shaped geometry to two equivalent La3+, two equivalent Pt, and two equivalent B3- atoms. Both Pt–B bond lengths are 2.22 Å. B3- is bonded in a 6-coordinate geometry to three equivalent La3+ and six equivalent Pt atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1211262
- 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; LaBPt4; B-La-Pt
- OSTI Identifier:
- 1666678
- DOI:
- https://doi.org/10.17188/1666678
Citation Formats
The Materials Project. Materials Data on LaBPt4 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1666678.
The Materials Project. Materials Data on LaBPt4 by Materials Project. United States. doi:https://doi.org/10.17188/1666678
The Materials Project. 2020.
"Materials Data on LaBPt4 by Materials Project". United States. doi:https://doi.org/10.17188/1666678. https://www.osti.gov/servlets/purl/1666678. Pub date:Wed Jul 22 00:00:00 EDT 2020
@article{osti_1666678,
title = {Materials Data on LaBPt4 by Materials Project},
author = {The Materials Project},
abstractNote = {LaPt4B crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. there are two inequivalent La3+ sites. In the first La3+ site, La3+ is bonded in a hexagonal planar geometry to six equivalent Pt atoms. All La–Pt bond lengths are 3.20 Å. In the second La3+ site, La3+ is bonded in a 12-coordinate geometry to twelve equivalent Pt and six equivalent B3- atoms. All La–Pt bond lengths are 3.17 Å. All La–B bond lengths are 3.20 Å. There are two inequivalent Pt sites. In the first Pt site, Pt is bonded in a 12-coordinate geometry to three equivalent La3+ and nine Pt atoms. There are six shorter (2.83 Å) and three longer (3.20 Å) Pt–Pt bond lengths. In the second Pt site, Pt is bonded in a distorted L-shaped geometry to two equivalent La3+, two equivalent Pt, and two equivalent B3- atoms. Both Pt–B bond lengths are 2.22 Å. B3- is bonded in a 6-coordinate geometry to three equivalent La3+ and six equivalent Pt atoms.},
doi = {10.17188/1666678},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}