U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on AsPd3Pb2 by Materials Project
Abstract
Pd3Pb2As crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 5-coordinate geometry to four Pd, four equivalent Pb, and two equivalent As atoms. There are a spread of Pd–Pd bond distances ranging from 2.92–3.16 Å. There are a spread of Pd–Pb bond distances ranging from 2.81–3.36 Å. There are one shorter (2.54 Å) and one longer (2.58 Å) Pd–As bond lengths. In the second Pd site, Pd is bonded in a 6-coordinate geometry to two equivalent Pd, four equivalent Pb, and two equivalent As atoms. There are two shorter (2.86 Å) and two longer (2.93 Å) Pd–Pb bond lengths. There are one shorter (2.50 Å) and one longer (2.64 Å) Pd–As bond lengths. Pb is bonded in a 5-coordinate geometry to six Pd atoms. As is bonded in a 6-coordinate geometry to six Pd atoms.
- Publication Date:
- Other Number(s):
- mp-20257
- 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; As-Pb-Pd; AsPd3Pb2; crystal structure
- OSTI Identifier:
- 1195388
- DOI:
- https://doi.org/10.17188/1195388
Citation Formats
Materials Data on AsPd3Pb2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1195388.
Materials Data on AsPd3Pb2 by Materials Project. United States. doi:https://doi.org/10.17188/1195388
2020.
"Materials Data on AsPd3Pb2 by Materials Project". United States. doi:https://doi.org/10.17188/1195388. https://www.osti.gov/servlets/purl/1195388. Pub date:Thu Jul 16 04:00:00 UTC 2020
@article{osti_1195388,
title = {Materials Data on AsPd3Pb2 by Materials Project},
abstractNote = {Pd3Pb2As crystallizes in the orthorhombic Cmc2_1 space group. The structure is three-dimensional. there are two inequivalent Pd sites. In the first Pd site, Pd is bonded in a 5-coordinate geometry to four Pd, four equivalent Pb, and two equivalent As atoms. There are a spread of Pd–Pd bond distances ranging from 2.92–3.16 Å. There are a spread of Pd–Pb bond distances ranging from 2.81–3.36 Å. There are one shorter (2.54 Å) and one longer (2.58 Å) Pd–As bond lengths. In the second Pd site, Pd is bonded in a 6-coordinate geometry to two equivalent Pd, four equivalent Pb, and two equivalent As atoms. There are two shorter (2.86 Å) and two longer (2.93 Å) Pd–Pb bond lengths. There are one shorter (2.50 Å) and one longer (2.64 Å) Pd–As bond lengths. Pb is bonded in a 5-coordinate geometry to six Pd atoms. As is bonded in a 6-coordinate geometry to six Pd atoms.},
doi = {10.17188/1195388},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}