Concepedia

Diffusion-free Grotthuss topochemistry for high-rate and long-life proton batteries

Xianyong Wu, Jessica J. Hong, Woochul Shin, Lu Ma, Tongchao Liu, Xuanxuan Bi, Yifei Yuan, Yitong Qi, T. Wesley Surta, Wenxi Huang,

Nature Energy · 2019 · 727 citations · 58 references

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58

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

<i>Ab initio</i>molecular dynamics for liquid metals

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations

, , +17

Fast Parallel Algorithms for Short-Range Molecular Dynamics

Steven J. Plimpton · Journal of Computational Physics · 1995 · 44.6K citations

, , +10