Materials Data on TiSe2 by Materials Project
Abstract
TiSe2 is trigonal omega structured and crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one TiSe2 sheet oriented in the (0, 0, 1) direction. Ti4+ is bonded to six equivalent Se2- atoms to form edge-sharing TiSe6 octahedra. All Ti–Se bond lengths are 2.57 Å. Se2- is bonded in a distorted T-shaped geometry to three equivalent Ti4+ atoms.
- Authors:
- Publication Date:
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Contributing Org.:
- MIT; UC Berkeley; Duke; U Louvain
- OSTI Identifier:
- 1197256
- Report Number(s):
- mp-2194
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Resource Type:
- Data
- Resource Relation:
- Related Information: https://materialsproject.org/citing
- Country of Publication:
- United States
- Language:
- English
- Subject:
- 36 MATERIALS SCIENCE; crystal structure; TiSe2; Se-Ti
Citation Formats
The Materials Project. Materials Data on TiSe2 by Materials Project. United States: N. p., 2017.
Web. doi:10.17188/1197256.
The Materials Project. Materials Data on TiSe2 by Materials Project. United States. https://doi.org/10.17188/1197256
The Materials Project. 2017.
"Materials Data on TiSe2 by Materials Project". United States. https://doi.org/10.17188/1197256. https://www.osti.gov/servlets/purl/1197256.
@article{osti_1197256,
title = {Materials Data on TiSe2 by Materials Project},
author = {The Materials Project},
abstractNote = {TiSe2 is trigonal omega structured and crystallizes in the trigonal P-3m1 space group. The structure is two-dimensional and consists of one TiSe2 sheet oriented in the (0, 0, 1) direction. Ti4+ is bonded to six equivalent Se2- atoms to form edge-sharing TiSe6 octahedra. All Ti–Se bond lengths are 2.57 Å. Se2- is bonded in a distorted T-shaped geometry to three equivalent Ti4+ atoms.},
doi = {10.17188/1197256},
url = {https://www.osti.gov/biblio/1197256},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Fri May 19 00:00:00 EDT 2017},
month = {Fri May 19 00:00:00 EDT 2017}
}
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