Concepedia

A revised mechanistic model for sodium insertion in hard carbons

Heather Au, Hande Alptekin, Anders C. S. Jensen, Emilia Olsson, Christopher A. O’Keefe, Thomas H. Smith, Maria Crespo Ribadeneyra, Thomas F. Headen, Clare P. Grey, Qiong Cai,

Energy & Environmental Science · 2020 · 480 citations · 63 references

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Abstract

Sodium filling inside hard carbon pores demonstrates increasingly metallic character with increasing pore size.

References

63

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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Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

Georg Kresse, J. Furthmüller · Physical review. B, Condensed matter · 1996 · 120.5K citations

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Projector augmented-wave method

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

, , +17

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

Georg Kresse, J. Furthmüller · Computational Materials Science · 1996 · 74.7K citations

, , +14

Special points for Brillouin-zone integrations

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

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