Concepedia

Non-oxidative coupling of methane over Mo-doped CeO2 catalysts: Understanding surface and gas-phase processes

Hao Zhang, Yaqiong Su, Nikolay Kosinov, Emiel J. M. Hensen

CHINESE JOURNAL OF CATALYSIS (CHINESE VERSION) · 2023 · 11 citations · 39 references

DOIFull text

Open access

Concepts

References

39

Generalized Gradient Approximation Made Simple

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

, , +16

Projector augmented-wave method

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

, , +17

<i>Ab initio</i>molecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1994 · 22.7K citations

, , +17

Electron-energy-loss spectra and the structural stability of nickel oxide:  An LSDA+U study

S. L. Dudarev, Gianluigi A. Botton, Sergey Y. Savrasov et al. · Physical review. B, Condensed matter · 1998 · 14.8K citations

, , +17

<i>GSAS-II</i>: the genesis of a modern open-source all purpose crystallography software package

Brian H. Toby, R. B. Von Dreele · Journal of Applied Crystallography · 2013 · 5.9K citations

, , +16