U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on V5As3 by Materials Project
Abstract
V5As3 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded in a 6-coordinate geometry to six As atoms. There are a spread of V–As bond distances ranging from 2.51–2.80 Å. In the second V site, V is bonded in a 4-coordinate geometry to four equivalent As atoms. All V–As bond lengths are 2.52 Å. There are two inequivalent As sites. In the first As site, As is bonded in a 10-coordinate geometry to ten V atoms. In the second As site, As is bonded in a 10-coordinate geometry to eight equivalent V and two equivalent As atoms. Both As–As bond lengths are 2.47 Å.
- Publication Date:
- Other Number(s):
- mp-7022
- 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; As-V; V5As3; crystal structure
- OSTI Identifier:
- 1285586
- DOI:
- https://doi.org/10.17188/1285586
Citation Formats
Materials Data on V5As3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1285586.
Materials Data on V5As3 by Materials Project. United States. doi:https://doi.org/10.17188/1285586
2020.
"Materials Data on V5As3 by Materials Project". United States. doi:https://doi.org/10.17188/1285586. https://www.osti.gov/servlets/purl/1285586. Pub date:Tue Jul 14 04:00:00 UTC 2020
@article{osti_1285586,
title = {Materials Data on V5As3 by Materials Project},
abstractNote = {V5As3 crystallizes in the tetragonal I4/mcm space group. The structure is three-dimensional. there are two inequivalent V sites. In the first V site, V is bonded in a 6-coordinate geometry to six As atoms. There are a spread of V–As bond distances ranging from 2.51–2.80 Å. In the second V site, V is bonded in a 4-coordinate geometry to four equivalent As atoms. All V–As bond lengths are 2.52 Å. There are two inequivalent As sites. In the first As site, As is bonded in a 10-coordinate geometry to ten V atoms. In the second As site, As is bonded in a 10-coordinate geometry to eight equivalent V and two equivalent As atoms. Both As–As bond lengths are 2.47 Å.},
doi = {10.17188/1285586},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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