U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on KSe3 by Materials Project
Abstract
KSe3 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. K is bonded in a 6-coordinate geometry to seven Se atoms. There are a spread of K–Se bond distances ranging from 3.37–3.75 Å. There are three inequivalent Se sites. In the first Se site, Se is bonded in a 4-coordinate geometry to two equivalent K and two Se atoms. There are one shorter (2.42 Å) and one longer (2.44 Å) Se–Se bond lengths. In the second Se site, Se is bonded in a distorted rectangular see-saw-like geometry to three equivalent K and one Se atom. The Se–Se bond length is 2.35 Å. In the third Se site, Se is bonded in a 4-coordinate geometry to two equivalent K and two Se atoms.
- Publication Date:
- Other Number(s):
- mp-1180659
- 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; K-Se; KSe3; crystal structure
- OSTI Identifier:
- 1731880
- DOI:
- https://doi.org/10.17188/1731880
Citation Formats
Materials Data on KSe3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1731880.
Materials Data on KSe3 by Materials Project. United States. doi:https://doi.org/10.17188/1731880
2020.
"Materials Data on KSe3 by Materials Project". United States. doi:https://doi.org/10.17188/1731880. https://www.osti.gov/servlets/purl/1731880. Pub date:Tue May 05 00:00:00 EDT 2020
@article{osti_1731880,
title = {Materials Data on KSe3 by Materials Project},
abstractNote = {KSe3 crystallizes in the monoclinic C2 space group. The structure is three-dimensional. K is bonded in a 6-coordinate geometry to seven Se atoms. There are a spread of K–Se bond distances ranging from 3.37–3.75 Å. There are three inequivalent Se sites. In the first Se site, Se is bonded in a 4-coordinate geometry to two equivalent K and two Se atoms. There are one shorter (2.42 Å) and one longer (2.44 Å) Se–Se bond lengths. In the second Se site, Se is bonded in a distorted rectangular see-saw-like geometry to three equivalent K and one Se atom. The Se–Se bond length is 2.35 Å. In the third Se site, Se is bonded in a 4-coordinate geometry to two equivalent K and two Se atoms.},
doi = {10.17188/1731880},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}
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