Materials Data on YMg3 by Materials Project
Abstract
YMg3 is Uranium Silicide structured and crystallizes in the orthorhombic Pmm2 space group. The structure is three-dimensional. there are three inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent Y atoms. All Mg–Mg bond lengths are 3.23 Å. There are two shorter (3.20 Å) and two longer (3.21 Å) Mg–Y bond lengths. In the second Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent Y atoms. All Mg–Mg bond lengths are 3.20 Å. All Mg–Y bond lengths are 3.23 Å. In the third Mg site, Mg is bonded to eight Mg and four equivalent Y atoms to form a mixture of corner and face-sharing MgY4Mg8 cuboctahedra. There are two shorter (3.55 Å) and two longer (3.60 Å) Mg–Y bond lengths. Y is bonded in a 12-coordinate geometry to twelve Mg atoms.
- Authors:
- Publication Date:
- Other Number(s):
- mp-1100166
- DOE Contract Number:
- AC02-05CH11231; EDCBEE
- Research Org.:
- Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States). LBNL Materials Project
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES)
- Collaborations:
- MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE
- Keywords:
- crystal structure; YMg3; Mg-Y
- OSTI Identifier:
- 1676598
- DOI:
- https://doi.org/10.17188/1676598
Citation Formats
The Materials Project. Materials Data on YMg3 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1676598.
The Materials Project. Materials Data on YMg3 by Materials Project. United States. doi:https://doi.org/10.17188/1676598
The Materials Project. 2020.
"Materials Data on YMg3 by Materials Project". United States. doi:https://doi.org/10.17188/1676598. https://www.osti.gov/servlets/purl/1676598. Pub date:Sat May 02 00:00:00 EDT 2020
@article{osti_1676598,
title = {Materials Data on YMg3 by Materials Project},
author = {The Materials Project},
abstractNote = {YMg3 is Uranium Silicide structured and crystallizes in the orthorhombic Pmm2 space group. The structure is three-dimensional. there are three inequivalent Mg sites. In the first Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent Y atoms. All Mg–Mg bond lengths are 3.23 Å. There are two shorter (3.20 Å) and two longer (3.21 Å) Mg–Y bond lengths. In the second Mg site, Mg is bonded in a distorted body-centered cubic geometry to four equivalent Mg and four equivalent Y atoms. All Mg–Mg bond lengths are 3.20 Å. All Mg–Y bond lengths are 3.23 Å. In the third Mg site, Mg is bonded to eight Mg and four equivalent Y atoms to form a mixture of corner and face-sharing MgY4Mg8 cuboctahedra. There are two shorter (3.55 Å) and two longer (3.60 Å) Mg–Y bond lengths. Y is bonded in a 12-coordinate geometry to twelve Mg atoms.},
doi = {10.17188/1676598},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {5}
}