Concepedia

Experimental and computational analysis of stacking fault energy in B-doped Fe50−XMn30Co10Cr10BX multi-principal elements alloys

José Y. Aguilar-Hurtado, Alejandro Vargas-Uscategui, Laura Gabriela Torres‐Mejia, L. Mujica Roncery, Dario Zambrano-Mera, Stefano Pantaleone, Bo Wang, Andreas Rosenkranz, Katherine Paredes‐Gil

Journal of Alloys and Compounds · 2023 · 16 citations · 103 references

Concepts

Natural SciencesMaterials EngineeringMaterials ScienceComputational Materials ScienceCrystal StructureSolid State PhysicsAlloy ThermodynamicsAlloysMetalsRare-earth-doped MaterialsStacking FaultsAtomistic Modeling Of Stacking FaultsFirst-principles Calculations Of Stacking FaultsStacking Fault EffectsStacking Fault EnergyStacking Fault FormationStacking Faults In Face-centered Cubic CrystalsStacking Faults In Hexagonal Close-packed Crystals

References

103

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

From ultrasoft pseudopotentials to the projector augmented-wave method

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

Natural Sciences, Chemistry, Physics +17

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

Georg Kresse, J. Furthmüller · Computational Materials Science · 1996 · 74.7K citations

Natural Sciences, Chemistry, Materials Science +14

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

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

Natural Sciences, Chemistry, Physics +17