Materials Data on PuGa by Materials Project
Abstract
PuGa crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. there are three inequivalent Pu sites. In the first Pu site, Pu is bonded in a 12-coordinate geometry to eight equivalent Ga atoms. All Pu–Ga bond lengths are 3.13 Å. In the second Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. There are four shorter (3.13 Å) and four longer (3.19 Å) Pu–Ga bond lengths. In the third Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. There are four shorter (3.12 Å) and four longer (3.20 Å) Pu–Ga bond lengths. Ga is bonded in a distorted q6 geometry to eight Pu and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.70 Å.
- Authors:
- Publication Date:
- Other Number(s):
- mp-29635
- 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; PuGa; Ga-Pu
- OSTI Identifier:
- 1204122
- DOI:
- https://doi.org/10.17188/1204122
Citation Formats
The Materials Project. Materials Data on PuGa by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1204122.
The Materials Project. Materials Data on PuGa by Materials Project. United States. doi:https://doi.org/10.17188/1204122
The Materials Project. 2020.
"Materials Data on PuGa by Materials Project". United States. doi:https://doi.org/10.17188/1204122. https://www.osti.gov/servlets/purl/1204122. Pub date:Thu Jul 16 00:00:00 EDT 2020
@article{osti_1204122,
title = {Materials Data on PuGa by Materials Project},
author = {The Materials Project},
abstractNote = {PuGa crystallizes in the tetragonal I4mm space group. The structure is three-dimensional. there are three inequivalent Pu sites. In the first Pu site, Pu is bonded in a 12-coordinate geometry to eight equivalent Ga atoms. All Pu–Ga bond lengths are 3.13 Å. In the second Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. There are four shorter (3.13 Å) and four longer (3.19 Å) Pu–Ga bond lengths. In the third Pu site, Pu is bonded in a 8-coordinate geometry to eight equivalent Ga atoms. There are four shorter (3.12 Å) and four longer (3.20 Å) Pu–Ga bond lengths. Ga is bonded in a distorted q6 geometry to eight Pu and two equivalent Ga atoms. Both Ga–Ga bond lengths are 2.70 Å.},
doi = {10.17188/1204122},
journal = {},
number = ,
volume = ,
place = {United States},
year = {Thu Jul 16 00:00:00 EDT 2020},
month = {Thu Jul 16 00:00:00 EDT 2020}
}
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