Concepedia

Unveiling the lattice distortion and electron-donating effects in methoxy-functionalized MOF photocatalysts for H2O2 production

Ling Yuan, Yingying Zou, Liang Zhao, Chaoqi Zhang, Jing Wang, Chao Liu, Guangfeng Wei, Chengzhong Yu

Applied Catalysis B: Environmental · 2022 · 63 citations · 59 references

DOI

Concepts

References

59

From ultrasoft pseudopotentials to the projector augmented-wave method

Georg Kresse, Daniel P. Joubert · Physical review. B, Condensed matter · 1999 · 83.6K 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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Generalized gradient approximation for the exchange-correlation hole of a many-electron system

John P. Perdew, Kieron Burke, Yue Wang · Physical review. B, Condensed matter · 1996 · 6.8K citations

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Electrolysis of water on (oxidized) metal surfaces

Jan Rossmeisl, Á. Logadóttir, Jens K. Nørskov · Chemical Physics · 2005 · 2K citations

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Defect Engineering: Tuning the Porosity and Composition of the Metal–Organic Framework UiO-66 via Modulated Synthesis

Greig C. Shearer, Sachin Chavan, Silvia Bordiga et al. · Chemistry of Materials · 2016 · 1.4K citations · Full text

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