Concepedia

Suitability of NaK alloy for the sodium or potassium metal batteries: Competition between cathode size effect and ion reaction priority effect

Taifeng Ding, Yong Chen, Wenlu Yuan, Laiping Li, Peizhi Mou, Yusheng Luo, Haoxiang Yu, Lei Yan, Jie Shu, Liyuan Zhang

Chemical Engineering Journal · 2023 · 19 citations · 57 references

DOI

Concepts

References

57

Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof · Physical Review Letters · 1996 · 211.5K citations · Full text

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Projector augmented-wave method

Peter E. Blöchl · Physical review. B, Condensed matter · 1994 · 90.8K citations

, , +17

Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

, , +6

Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction

Stefan Grimme · Journal of Computational Chemistry · 2006 · 30.8K citations

, , +17

<i>Ab‐initio</i>simulations of materials using VASP: Density‐functional theory and beyond

Jürgen Häfner · Journal of Computational Chemistry · 2008 · 4.9K citations

, , +17