U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on KSe by Materials Project
Abstract
KSe crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a 6-coordinate geometry to six Se1- atoms. There are two shorter (3.39 Å) and four longer (3.46 Å) K–Se bond lengths. In the second K1+ site, K1+ is bonded in a 6-coordinate geometry to six Se1- atoms. There are four shorter (3.32 Å) and two longer (3.39 Å) K–Se bond lengths. There are two inequivalent Se1- sites. In the first Se1- site, Se1- is bonded in a 7-coordinate geometry to six K1+ and one Se1- atom. The Se–Se bond length is 2.45 Å. In the second Se1- site, Se1- is bonded in a 7-coordinate geometry to six K1+ and one Se1- atom. The Se–Se bond length is 2.44 Å.
- Publication Date:
- Other Number(s):
- mp-9268
- 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; KSe; crystal structure
- OSTI Identifier:
- 1313102
- DOI:
- https://doi.org/10.17188/1313102
Citation Formats
Materials Data on KSe by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1313102.
Materials Data on KSe by Materials Project. United States. doi:https://doi.org/10.17188/1313102
2020.
"Materials Data on KSe by Materials Project". United States. doi:https://doi.org/10.17188/1313102. https://www.osti.gov/servlets/purl/1313102. Pub date:Tue Jul 14 04:00:00 UTC 2020
@article{osti_1313102,
title = {Materials Data on KSe by Materials Project},
abstractNote = {KSe crystallizes in the hexagonal P-62m space group. The structure is three-dimensional. there are two inequivalent K1+ sites. In the first K1+ site, K1+ is bonded in a 6-coordinate geometry to six Se1- atoms. There are two shorter (3.39 Å) and four longer (3.46 Å) K–Se bond lengths. In the second K1+ site, K1+ is bonded in a 6-coordinate geometry to six Se1- atoms. There are four shorter (3.32 Å) and two longer (3.39 Å) K–Se bond lengths. There are two inequivalent Se1- sites. In the first Se1- site, Se1- is bonded in a 7-coordinate geometry to six K1+ and one Se1- atom. The Se–Se bond length is 2.45 Å. In the second Se1- site, Se1- is bonded in a 7-coordinate geometry to six K1+ and one Se1- atom. The Se–Se bond length is 2.44 Å.},
doi = {10.17188/1313102},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}