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NaxCoO2 phase stability and hierarchical orderings in the O3/P3 structure family
https://doi.org/10.18126/m2505p
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The dataset contains VASP calculations for Na-vacancy orderings in various host structures of NaxCoO2 enumerated using the CASM code (https://github.com/prisms-center/CASMcode).
Jonas L. Kaufman
Anton Van der Ven
Jonas L. Kaufman (jlk@ucsb.edu)
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Anton Van der Ven (avdv@ucsb.edu)
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DOI registered
December 31, 2018
via DataCite
Dataset published 2018 in
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