Concepedia

Charge compensation doping to improve the photocatalytic and photoelectrochemical activities of Ta3N5: A theoretical study

Jiajia Wang, Yaqing Jiang, Aibin Ma, Jinghua Jiang, Jianqing Chen, Mingxue Li, Jianyong Feng, Zhaosheng Li, Zhigang Zou

Applied Catalysis B: Environmental · 2018 · 35 citations · 61 references

DOI

Concepts

References

61

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

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

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

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Electrochemical Photolysis of Water at a Semiconductor Electrode

Akira Fujishima, Kenichi Honda · Nature · 1972 · 33.7K citations

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