Concepedia

Pt-like catalytic activity from an atomistically engineered carbonitride MXene for sustainable hydrogen production

Ekenedilichukwu Uwadiunor, Vrushali Kotasthane, David Kumar Yesudoss, Hoang Nguyen, Eugenie Pranada, Kingsley Onyebuchi Obodo, Miladin Radović, Abdoulaye Djire

Chem Catalysis · 2023 · 12 citations · 78 references

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Concepts

References

78

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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Self-Consistent Equations Including Exchange and Correlation Effects

W. Kohn, L. J. Sham · Physical Review · 1965 · 63.2K citations · Full text

, , +15

Accurate and simple analytic representation of the electron-gas correlation energy

John P. Perdew, Yue Wang · Physical review. B, Condensed matter · 1992 · 24.9K citations

, , +14

Self-interaction correction to density-functional approximations for many-electron systems

John P. Perdew, Alex Zunger · Physical review. B, Condensed matter · 1981 · 20.8K citations · Full text

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First principles methods using CASTEP

Stewart J. Clark, Matthew Segall, Chris J. Pickard et al. · Zeitschrift für Kristallographie - Crystalline Materials · 2005 · 14.4K citations · Full text

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