Materials Data on PuPt5 by Materials Project
PuPt5 crystallizes in the hexagonal P6/mmm space group. The structure is three-dimensional. Pu6+ is bonded in a distorted hexagonal planar geometry to eighteen Pt+1.20- atoms. There are six shorter (3.08 Å) and twelve longer (3.48 Å) Pu–Pt bond lengths. There are two inequivalent Pt+1.20- sites. In the first Pt+1.20- site, Pt+1.20- is bonded to four equivalent Pu6+ and eight Pt+1.20- atoms to form a mixture of corner, edge, and face-sharing PtPu4Pt8 cuboctahedra. There are four shorter (2.67 Å) and four longer (2.71 Å) Pt–Pt bond lengths. In the second Pt+1.20- site, Pt+1.20- is bonded in a 12-coordinate geometry to three equivalent Pu6+ and nine Pt+1.20- atoms. All Pt–Pt bond lengths are 3.08 Å.
- Research Organization:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Organization:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Contributing Organization:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- DOE Contract Number:
- AC02-05CH11231
- OSTI ID:
- 1302780
- Report Number(s):
- mp-7751
- Country of Publication:
- United States
- Language:
- English
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