U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CsEuCl3 by Materials Project
Abstract
CsEuCl3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight Cl1- atoms. There are a spread of Cs–Cl bond distances ranging from 3.50–3.90 Å. Eu2+ is bonded to six Cl1- atoms to form corner-sharing EuCl6 octahedra. The corner-sharing octahedra tilt angles range from 26–27°. There are two shorter (2.87 Å) and four longer (2.92 Å) Eu–Cl bond lengths. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a 5-coordinate geometry to three equivalent Cs1+ and two equivalent Eu2+ atoms. In the second Cl1- site, Cl1- is bonded to two equivalent Cs1+ and two equivalent Eu2+ atoms to form distorted corner-sharing ClCs2Eu2 tetrahedra.
- Publication Date:
- Other Number(s):
- mp-1213256
- 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; Cl-Cs-Eu; CsEuCl3; crystal structure
- OSTI Identifier:
- 1698728
- DOI:
- https://doi.org/10.17188/1698728
Citation Formats
Materials Data on CsEuCl3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1698728.
Materials Data on CsEuCl3 by Materials Project. United States. doi:https://doi.org/10.17188/1698728
2020.
"Materials Data on CsEuCl3 by Materials Project". United States. doi:https://doi.org/10.17188/1698728. https://www.osti.gov/servlets/purl/1698728. Pub date:Thu Apr 30 00:00:00 EDT 2020
@article{osti_1698728,
title = {Materials Data on CsEuCl3 by Materials Project},
abstractNote = {CsEuCl3 is Orthorhombic Perovskite structured and crystallizes in the orthorhombic Pnma space group. The structure is three-dimensional. Cs1+ is bonded in a 8-coordinate geometry to eight Cl1- atoms. There are a spread of Cs–Cl bond distances ranging from 3.50–3.90 Å. Eu2+ is bonded to six Cl1- atoms to form corner-sharing EuCl6 octahedra. The corner-sharing octahedra tilt angles range from 26–27°. There are two shorter (2.87 Å) and four longer (2.92 Å) Eu–Cl bond lengths. There are two inequivalent Cl1- sites. In the first Cl1- site, Cl1- is bonded in a 5-coordinate geometry to three equivalent Cs1+ and two equivalent Eu2+ atoms. In the second Cl1- site, Cl1- is bonded to two equivalent Cs1+ and two equivalent Eu2+ atoms to form distorted corner-sharing ClCs2Eu2 tetrahedra.},
doi = {10.17188/1698728},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {4}
}