U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on NbH by Materials Project
Abstract
NbH is Halite, Rock Salt-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Nb is bonded to six equivalent H atoms to form a mixture of corner and edge-sharing NbH6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are two shorter (1.98 Å) and four longer (2.27 Å) Nb–H bond lengths. H is bonded to six equivalent Nb atoms to form a mixture of corner and edge-sharing HNb6 octahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-1220318
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; H-Nb; NbH; crystal structure
- OSTI Identifier:
- 1680827
- DOI:
- https://doi.org/10.17188/1680827
Citation Formats
Materials Data on NbH by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1680827.
Materials Data on NbH by Materials Project. United States. doi:https://doi.org/10.17188/1680827
2019.
"Materials Data on NbH by Materials Project". United States. doi:https://doi.org/10.17188/1680827. https://www.osti.gov/servlets/purl/1680827. Pub date:Fri Jan 11 23:00:00 EST 2019
@article{osti_1680827,
title = {Materials Data on NbH by Materials Project},
abstractNote = {NbH is Halite, Rock Salt-like structured and crystallizes in the tetragonal I4/mmm space group. The structure is three-dimensional. Nb is bonded to six equivalent H atoms to form a mixture of corner and edge-sharing NbH6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are two shorter (1.98 Å) and four longer (2.27 Å) Nb–H bond lengths. H is bonded to six equivalent Nb atoms to form a mixture of corner and edge-sharing HNb6 octahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1680827},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2019},
month = {1}
}
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