U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Ti2AlCr by Materials Project
Abstract
Ti2CrAl is Tungsten-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Ti sites. In the first Ti site, Ti is bonded in a 8-coordinate geometry to four equivalent Ti, six equivalent Cr, and four equivalent Al atoms. All Ti–Ti bond lengths are 2.73 Å. All Ti–Cr bond lengths are 3.15 Å. All Ti–Al bond lengths are 2.73 Å. In the second Ti site, Ti is bonded in a 8-coordinate geometry to four equivalent Ti, four equivalent Cr, and six equivalent Al atoms. All Ti–Cr bond lengths are 2.73 Å. All Ti–Al bond lengths are 3.15 Å. Cr is bonded in a distorted body-centered cubic geometry to ten Ti and four equivalent Al atoms. All Cr–Al bond lengths are 2.73 Å. Al is bonded in a distorted body-centered cubic geometry to ten Ti and four equivalent Cr atoms.
- Publication Date:
- Other Number(s):
- mp-999096
- 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-Cr-Ti; Ti2AlCr; crystal structure
- OSTI Identifier:
- 1317470
- DOI:
- https://doi.org/10.17188/1317470
Citation Formats
Materials Data on Ti2AlCr by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1317470.
Materials Data on Ti2AlCr by Materials Project. United States. doi:https://doi.org/10.17188/1317470
2020.
"Materials Data on Ti2AlCr by Materials Project". United States. doi:https://doi.org/10.17188/1317470. https://www.osti.gov/servlets/purl/1317470. Pub date:Thu Jun 04 04:00:00 UTC 2020
@article{osti_1317470,
title = {Materials Data on Ti2AlCr by Materials Project},
abstractNote = {Ti2CrAl is Tungsten-derived structured and crystallizes in the cubic F-43m space group. The structure is three-dimensional. there are two inequivalent Ti sites. In the first Ti site, Ti is bonded in a 8-coordinate geometry to four equivalent Ti, six equivalent Cr, and four equivalent Al atoms. All Ti–Ti bond lengths are 2.73 Å. All Ti–Cr bond lengths are 3.15 Å. All Ti–Al bond lengths are 2.73 Å. In the second Ti site, Ti is bonded in a 8-coordinate geometry to four equivalent Ti, four equivalent Cr, and six equivalent Al atoms. All Ti–Cr bond lengths are 2.73 Å. All Ti–Al bond lengths are 3.15 Å. Cr is bonded in a distorted body-centered cubic geometry to ten Ti and four equivalent Al atoms. All Cr–Al bond lengths are 2.73 Å. Al is bonded in a distorted body-centered cubic geometry to ten Ti and four equivalent Cr atoms.},
doi = {10.17188/1317470},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {6}
}