Pinning effect of reactive elements on structural stability and adhesive strength of environmental sulfur segregation on Al2O3/NiAl interface

Generalized Gradient Approximation Made Simple

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

Natural Sciences, Chemistry, Physics +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

Natural Sciences, Chemistry, Computational Chemistry +15

<i>Ab initio</i>molecular dynamics for open-shell transition metals

Georg Kresse, J. Häfner · Physical review. B, Condensed matter · 1993 · 8.2K citations

Natural Sciences, Chemistry, Physics +14

Current Thoughts on Reactive Element Effects in Alumina-Forming Systems: In Memory of John Stringer

D. Naumenko, Bruce A. Pint, W. J. Quadakkers · Oxidation of Metals · 2016 · 249 citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17

Effects of segregating elements on the adhesive strength and structure of the α-Al2O3/β-NiAl interface

Karin M. Carling, Emily A. Carter · Acta Materialia · 2007 · 122 citations

Natural Sciences, Materials Engineering, Materials Science +14