Concepedia

Influence of grain boundaries on the radiation-induced defects and hydrogen in nanostructured and coarse-grained tungsten

G. Valles, M. Panizo-Laiz, César González, Ignacio Martin‐Bragado, R. González-Arrabal, N. Gordillo, R. Iglesias, Carlo Guerrero, J.M. Perlado, A. Rivera

Acta Materialia · 2016 · 91 citations · 55 references

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Concepts

References

55

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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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

From ultrasoft pseudopotentials to the projector augmented-wave method

Georg Kresse, Daniel P. Joubert · Physical review. B, Condensed matter · 1999 · 83.6K citations

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<i>Ab initio</i>molecular dynamics for liquid metals

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 44.9K citations

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