Concepedia

Theoretical insights into the surface growth of rutile TiO2

R. Shirley, Jethro Akroyd, L. A. Miller, Oliver R. Inderwildi, Uwe Riedel, Markus Kraft

Combustion and Flame · 2011 · 25 citations · 33 references

DOI

Concepts

References

33

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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Special points for Brillouin-zone integrations

Hendrik J. Monkhorst, J.D. Pack · Physical review. B, Solid state · 1976 · 70.3K citations

, , +6

Soft self-consistent pseudopotentials in a generalized eigenvalue formalism

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

, , +13

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

, , +17

The surface science of titanium dioxide

Ulrike Diebold · Surface Science Reports · 2003 · 7.8K citations

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