U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Er5(In2Pd)2 by Materials Project
Abstract
Er5(PdIn2)2 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Er sites. In the first Er site, Er is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.19 Å) and four longer (3.32 Å) Er–In bond lengths. In the second Er site, Er is bonded in a 10-coordinate geometry to four equivalent Pd and six In atoms. There are two shorter (2.94 Å) and two longer (2.96 Å) Er–Pd bond lengths. There are a spread of Er–In bond distances ranging from 3.31–3.43 Å. In the third Er site, Er is bonded in a 8-coordinate geometry to two equivalent Pd and six In atoms. Both Er–Pd bond lengths are 2.84 Å. There are a spread of Er–In bond distances ranging from 3.21–3.40 Å. Pd is bonded in a 9-coordinate geometry to six Er and three In atoms. There are a spread of Pd–In bond distances ranging from 2.95–3.30 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Er, one Pd, and one In atom. The In–In bond length is 3.31 Å. In the second In site,more »
- Publication Date:
- Other Number(s):
- mp-1190725
- 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; Er-In-Pd; Er5(In2Pd)2; crystal structure
- OSTI Identifier:
- 1682824
- DOI:
- https://doi.org/10.17188/1682824
Citation Formats
Materials Data on Er5(In2Pd)2 by Materials Project. United States: N. p., 2019.
Web. doi:10.17188/1682824.
Materials Data on Er5(In2Pd)2 by Materials Project. United States. doi:https://doi.org/10.17188/1682824
2019.
"Materials Data on Er5(In2Pd)2 by Materials Project". United States. doi:https://doi.org/10.17188/1682824. https://www.osti.gov/servlets/purl/1682824. Pub date:Thu Jan 10 23:00:00 EST 2019
@article{osti_1682824,
title = {Materials Data on Er5(In2Pd)2 by Materials Project},
abstractNote = {Er5(PdIn2)2 crystallizes in the orthorhombic Pbam space group. The structure is three-dimensional. there are three inequivalent Er sites. In the first Er site, Er is bonded in a distorted body-centered cubic geometry to eight In atoms. There are four shorter (3.19 Å) and four longer (3.32 Å) Er–In bond lengths. In the second Er site, Er is bonded in a 10-coordinate geometry to four equivalent Pd and six In atoms. There are two shorter (2.94 Å) and two longer (2.96 Å) Er–Pd bond lengths. There are a spread of Er–In bond distances ranging from 3.31–3.43 Å. In the third Er site, Er is bonded in a 8-coordinate geometry to two equivalent Pd and six In atoms. Both Er–Pd bond lengths are 2.84 Å. There are a spread of Er–In bond distances ranging from 3.21–3.40 Å. Pd is bonded in a 9-coordinate geometry to six Er and three In atoms. There are a spread of Pd–In bond distances ranging from 2.95–3.30 Å. There are two inequivalent In sites. In the first In site, In is bonded in a 9-coordinate geometry to eight Er, one Pd, and one In atom. The In–In bond length is 3.31 Å. In the second In site, In is bonded in a 11-coordinate geometry to eight Er, two equivalent Pd, and one In atom.},
doi = {10.17188/1682824},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jan 10 23:00:00 EST 2019},
month = {Thu Jan 10 23:00:00 EST 2019}
}