U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on CsSmCl3 by Materials Project
Abstract
CsSmCl3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Cl1- atoms to form CsCl12 cuboctahedra that share corners with twelve equivalent CsCl12 cuboctahedra, faces with six equivalent CsCl12 cuboctahedra, and faces with eight equivalent SmCl6 octahedra. All Cs–Cl bond lengths are 3.89 Å. Sm2+ is bonded to six equivalent Cl1- atoms to form SmCl6 octahedra that share corners with six equivalent SmCl6 octahedra and faces with eight equivalent CsCl12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sm–Cl bond lengths are 2.75 Å. Cl1- is bonded in a distorted linear geometry to four equivalent Cs1+ and two equivalent Sm2+ atoms.
- Publication Date:
- Other Number(s):
- mp-567939
- 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-Sm; crystal structure; CsSmCl3
- OSTI Identifier:
- 1274138
- DOI:
- https://doi.org/10.17188/1274138
Citation Formats
Materials Data on CsSmCl3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1274138.
Materials Data on CsSmCl3 by Materials Project. United States. doi:https://doi.org/10.17188/1274138
2020.
"Materials Data on CsSmCl3 by Materials Project". United States. doi:https://doi.org/10.17188/1274138. https://www.osti.gov/servlets/purl/1274138. Pub date:Wed Jul 15 20:00:00 EDT 2020
@article{osti_1274138,
title = {Materials Data on CsSmCl3 by Materials Project},
abstractNote = {CsSmCl3 is (Cubic) Perovskite structured and crystallizes in the cubic Pm-3m space group. The structure is three-dimensional. Cs1+ is bonded to twelve equivalent Cl1- atoms to form CsCl12 cuboctahedra that share corners with twelve equivalent CsCl12 cuboctahedra, faces with six equivalent CsCl12 cuboctahedra, and faces with eight equivalent SmCl6 octahedra. All Cs–Cl bond lengths are 3.89 Å. Sm2+ is bonded to six equivalent Cl1- atoms to form SmCl6 octahedra that share corners with six equivalent SmCl6 octahedra and faces with eight equivalent CsCl12 cuboctahedra. The corner-sharing octahedral tilt angles are 0°. All Sm–Cl bond lengths are 2.75 Å. Cl1- is bonded in a distorted linear geometry to four equivalent Cs1+ and two equivalent Sm2+ atoms.},
doi = {10.17188/1274138},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}