Materials Data on BaCu by Materials Project
BaCu crystallizes in the hexagonal P6_3/mmc space group. The structure is two-dimensional and consists of two BaCu sheets oriented in the (0, 0, 1) direction. Ba is bonded in a 6-coordinate geometry to six equivalent Cu atoms. All Ba–Cu bond lengths are 3.34 Å. Cu is bonded in a 9-coordinate geometry to six equivalent Ba and three equivalent Cu atoms. All Cu–Cu bond lengths are 2.60 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:
- 1204837
- Report Number(s):
- mp-30428
- Country of Publication:
- United States
- Language:
- English
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