Concepedia

Revealing DeNOx and DeVOC Reactions via the Study of the Surface and Bandstructure of ZnSn(OH)6 Photocatalysts

Minh‐Thuan Pham, Hong Huy Tran, Truc-Mai T. Nguyen, Dai‐Phat Bui, Yu Huang, Junji Cao, Sheng‐Jie You, Viet Van Pham, Nam Hoang Vu, Ya‐Fen Wang

Acta Materialia · 2021 · 43 citations · 45 references

DOI

Concepts

References

45

Generalized Gradient Approximation Made Simple

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

, , +16

Advanced capabilities for materials modelling with Quantum ESPRESSO

Oxford University Research Archive (ORA) (University of Oxford) · 2017 · 3.8K citations

, , +16

S-Scheme Heterojunction Photocatalyst

Quanlong Xu, Liuyang Zhang, Bei Cheng et al. · Chem · 2020 · 3.7K citations · Full text

Chemical accuracy for the van der Waals density functional

Jiří Klimeš, David R. Bowler, Angelos Michaelides · Journal of Physics Condensed Matter · 2009 · 3.6K citations

, , +11

Langmuir–Hinshelwood kinetics – A theoretical study

K. Vasanth Kumar, K. Porkodi, Fernando Rocha · Catalysis Communications · 2007 · 837 citations

, , +12