U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on NdTaO4 by Materials Project
Abstract
NdTaO4 crystallizes in the monoclinic P2/c space group. The structure is three-dimensional. Nd3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Nd–O bond distances ranging from 2.39–2.62 Å. Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.88–2.23 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Nd3+ and one Ta5+ atom. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Nd3+ and two equivalent Ta5+ atoms.
- Publication Date:
- Other Number(s):
- mp-3203
- 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; Nd-O-Ta; NdTaO4; crystal structure
- OSTI Identifier:
- 1206059
- DOI:
- https://doi.org/10.17188/1206059
Citation Formats
Materials Data on NdTaO4 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1206059.
Materials Data on NdTaO4 by Materials Project. United States. doi:https://doi.org/10.17188/1206059
2017.
"Materials Data on NdTaO4 by Materials Project". United States. doi:https://doi.org/10.17188/1206059. https://www.osti.gov/servlets/purl/1206059. Pub date:Wed May 10 04:00:00 UTC 2017
@article{osti_1206059,
title = {Materials Data on NdTaO4 by Materials Project},
abstractNote = {NdTaO4 crystallizes in the monoclinic P2/c space group. The structure is three-dimensional. Nd3+ is bonded in a 8-coordinate geometry to eight O2- atoms. There are a spread of Nd–O bond distances ranging from 2.39–2.62 Å. Ta5+ is bonded in a 6-coordinate geometry to six O2- atoms. There are a spread of Ta–O bond distances ranging from 1.88–2.23 Å. There are two inequivalent O2- sites. In the first O2- site, O2- is bonded in a 3-coordinate geometry to two equivalent Nd3+ and one Ta5+ atom. In the second O2- site, O2- is bonded in a 4-coordinate geometry to two equivalent Nd3+ and two equivalent Ta5+ atoms.},
doi = {10.17188/1206059},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2017},
month = {5}
}
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