U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on HPbI3 by Materials Project
Abstract
HPbI3 is (Cubic) Perovskite structured and crystallizes in the trigonal R3m space group. The structure is three-dimensional and consists of three hydrogen molecules and one PbI3 framework. In the PbI3 framework, Pb2+ is bonded to six equivalent I1- atoms to form corner-sharing PbI6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are three shorter (3.11 Å) and three longer (3.12 Å) Pb–I bond lengths. I1- is bonded in a linear geometry to two equivalent Pb2+ atoms.
- Publication Date:
- Other Number(s):
- mp-1004524
- 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; H-I-Pb; HPbI3; crystal structure
- OSTI Identifier:
- 1305229
- DOI:
- https://doi.org/10.17188/1305229
Citation Formats
Materials Data on HPbI3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1305229.
Materials Data on HPbI3 by Materials Project. United States. doi:https://doi.org/10.17188/1305229
2020.
"Materials Data on HPbI3 by Materials Project". United States. doi:https://doi.org/10.17188/1305229. https://www.osti.gov/servlets/purl/1305229. Pub date:Mon Jul 20 04:00:00 UTC 2020
@article{osti_1305229,
title = {Materials Data on HPbI3 by Materials Project},
abstractNote = {HPbI3 is (Cubic) Perovskite structured and crystallizes in the trigonal R3m space group. The structure is three-dimensional and consists of three hydrogen molecules and one PbI3 framework. In the PbI3 framework, Pb2+ is bonded to six equivalent I1- atoms to form corner-sharing PbI6 octahedra. The corner-sharing octahedral tilt angles are 0°. There are three shorter (3.11 Å) and three longer (3.12 Å) Pb–I bond lengths. I1- is bonded in a linear geometry to two equivalent Pb2+ atoms.},
doi = {10.17188/1305229},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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