U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Er3AlN by Materials Project
Abstract
Er3AlN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Er is bonded in a linear geometry to four equivalent Al and two equivalent N atoms. All Er–Al bond lengths are 3.33 Å. Both Er–N bond lengths are 2.36 Å. Al is bonded to twelve equivalent Er atoms to form AlEr12 cuboctahedra that share corners with twelve equivalent AlEr12 cuboctahedra, faces with six equivalent AlEr12 cuboctahedra, and faces with eight equivalent NEr6 octahedra. N is bonded to six equivalent Er atoms to form NEr6 octahedra that share corners with six equivalent NEr6 octahedra and faces with eight equivalent AlEr12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.
- Publication Date:
- Other Number(s):
- mp-1017558
- 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; Al-Er-N; Er3AlN; crystal structure
- OSTI Identifier:
- 1349811
- DOI:
- https://doi.org/10.17188/1349811
Citation Formats
Materials Data on Er3AlN by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1349811.
Materials Data on Er3AlN by Materials Project. United States. doi:https://doi.org/10.17188/1349811
2020.
"Materials Data on Er3AlN by Materials Project". United States. doi:https://doi.org/10.17188/1349811. https://www.osti.gov/servlets/purl/1349811. Pub date:Thu Jul 23 04:00:00 UTC 2020
@article{osti_1349811,
title = {Materials Data on Er3AlN by Materials Project},
abstractNote = {Er3AlN is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Er is bonded in a linear geometry to four equivalent Al and two equivalent N atoms. All Er–Al bond lengths are 3.33 Å. Both Er–N bond lengths are 2.36 Å. Al is bonded to twelve equivalent Er atoms to form AlEr12 cuboctahedra that share corners with twelve equivalent AlEr12 cuboctahedra, faces with six equivalent AlEr12 cuboctahedra, and faces with eight equivalent NEr6 octahedra. N is bonded to six equivalent Er atoms to form NEr6 octahedra that share corners with six equivalent NEr6 octahedra and faces with eight equivalent AlEr12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°.},
doi = {10.17188/1349811},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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