Concepedia

Alumina-supported sub-nanometer Pt<sub>10</sub> clusters: amorphization and role of the support material in a highly active CO oxidation catalyst

Chunrong Yin, Fábio R. Negreiros, Giovanni Barcaro, Atsushi Beniya, Luca Sementa, Eric C. Tyo, Stephan Bartling, K.‐H. Meiwes‐Broer, Sönke Seifert, Hirohito Hirata,

Journal of Materials Chemistry A · 2017 · 85 citations · 62 references

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Concepts

Abstract

Bridging the support gap in heterogeneous ultrananocatalysis.

References

62

Generalized Gradient Approximation Made Simple

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

, , +16

Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

Georg Kresse, J. Furthmüller · Physical review. B, Condensed matter · 1996 · 120.5K citations

, , +15

Projector augmented-wave method

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

, , +17

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

Paolo Giannozzi, Stefano Baroni, Nicola Bonini et al. · Journal of Physics Condensed Matter · 2009 · 28.8K citations · Full text

, , +17

Soft self-consistent pseudopotentials in a generalized eigenvalue formalism

David Vanderbilt · Physical review. B, Condensed matter · 1990 · 22.9K citations

, , +13