Concepedia

Selective Etching Quaternary MAX Phase toward Single Atom Copper Immobilized MXene (Ti<sub>3</sub>C<sub>2</sub>Cl<sub><i>x</i></sub>) for Efficient CO<sub>2</sub> Electroreduction to Methanol

Qi Zhao, Chao Zhang, Riming Hu, Zhiguo Du, Jianan Gu, Yanglansen Cui, Xiao Chen, Wenjie Xu, Zongju Cheng, Songmei Li,

ACS Nano · 2021 · 279 citations · 54 references

DOI

Concepts

Abstract

OH.

References

54

Generalized Gradient Approximation Made Simple

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

, , +16

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

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Projector augmented-wave method

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

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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

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Special points for Brillouin-zone integrations

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

, , +6