U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on HfMoSe by Materials Project
Abstract
HfMoSe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to four equivalent Mo and four equivalent Se atoms. All Hf–Mo bond lengths are 2.75 Å. All Hf–Se bond lengths are 2.75 Å. Mo is bonded to four equivalent Hf atoms to form distorted MoHf4 tetrahedra that share corners with four equivalent SeHf4 tetrahedra, corners with twelve equivalent MoHf4 tetrahedra, and edges with six equivalent SeHf4 tetrahedra. Se is bonded to four equivalent Hf atoms to form distorted SeHf4 tetrahedra that share corners with four equivalent MoHf4 tetrahedra, corners with twelve equivalent SeHf4 tetrahedra, and edges with six equivalent MoHf4 tetrahedra.
- Authors:
- Publication Date:
- Other Number(s):
- mp-631294
- 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; HfMoSe; Hf-Mo-Se
- OSTI Identifier:
- 1279048
- DOI:
- https://doi.org/10.17188/1279048
Citation Formats
The Materials Project. Materials Data on HfMoSe by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1279048.
The Materials Project. Materials Data on HfMoSe by Materials Project. United States. doi:https://doi.org/10.17188/1279048
The Materials Project. 2020.
"Materials Data on HfMoSe by Materials Project". United States. doi:https://doi.org/10.17188/1279048. https://www.osti.gov/servlets/purl/1279048. Pub date:Mon Jul 20 00:00:00 EDT 2020
@article{osti_1279048,
title = {Materials Data on HfMoSe by Materials Project},
author = {The Materials Project},
abstractNote = {HfMoSe is half-Heusler structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. Hf is bonded in a body-centered cubic geometry to four equivalent Mo and four equivalent Se atoms. All Hf–Mo bond lengths are 2.75 Å. All Hf–Se bond lengths are 2.75 Å. Mo is bonded to four equivalent Hf atoms to form distorted MoHf4 tetrahedra that share corners with four equivalent SeHf4 tetrahedra, corners with twelve equivalent MoHf4 tetrahedra, and edges with six equivalent SeHf4 tetrahedra. Se is bonded to four equivalent Hf atoms to form distorted SeHf4 tetrahedra that share corners with four equivalent MoHf4 tetrahedra, corners with twelve equivalent SeHf4 tetrahedra, and edges with six equivalent MoHf4 tetrahedra.},
doi = {10.17188/1279048},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}