Generalized Gradient Approximation Made Simple

John P. Perdew, Kieron Burke, Matthias Ernzerhof

Physical Review Letters

Numerical AnalysisEngineeringMachine LearningVariational AnalysisSimple Gga +17

Thermo-Calc & DICTRA, computational tools for materials science

J. Y. Andersson, Thomas Helander, Lars Höglund, +2

Calphad

Materials ScienceHigh Temperature MaterialsEngineeringMaterial SimulationApplied Physics +2

Anisotropic Lattice Distortions in Random Alloys from First-Principles Theory

Levente Vitos, Igor A. Abrikosov, B. Johansson

Physical Review Letters

Total EnergyQuantum Lattice SystemEngineeringFcd-emto-cpa MethodMetallic Functional Material +15

Application of the exact muffin-tin orbitals theory: the spherical cell approximation

Levente Vitos, H. L. Skriver, B. Johansson, +1

Computational Materials Science

EngineeringPhysicsSpherical Cell ApproximationNatural SciencesApplied Physics +7

Ab initio formation energies of Fe–Cr alloys

Pär Olsson, Igor A. Abrikosov, L. Vitos, +1

Journal of Nuclear Materials

Materials EngineeringMaterials ScienceMagnetic PropertiesEngineeringFe–cr Alloys +3

Atom Probe Studies of the Fe–Cr System and Stainless Steels Aged at Intermediate Temperature

F. Danoix, Peter Auger

Materials Characterization

Materials ScienceMaterials EngineeringEngineeringCorrosionFe–cr System +5

Effect of 475°C embrittlement on the mechanical properties of duplex stainless steel

Jitendra Kumar Sahu, Ulrich Krupp, R.N. Ghosh, +1

Materials Science and Engineering A

Materials ScienceEngineeringMechanical PropertiesMechanical EngineeringHigh Strength Low Alloy Steel +3

High temperature oxidation of Fe–Al and Fe–Cr–Al alloys: The role of Cr as a chemically active element

E. Airiskallio, E. Nurmi, M. H. Heinonen, +9

Corrosion Science

Materials ScienceMaterials EngineeringChemical EngineeringActive ElementHigh Temperature Materials +9

Mapping of 475 °C embrittlement in ferritic Fe–Cr–Al alloys

Satoru Kobayashi, Takayuki Takasugi

Scripta Materialia

Materials ScienceMaterials EngineeringEngineering°C EmbrittlementAlloy Design +2

An improved thermodynamic modeling of the Fe–Cr system down to zero kelvin coupled with key experiments

Wei Xiong, Peter Hedström, Malin Selleby, +3

Calphad

Thermodynamic ModellingElectrical EngineeringImproved Thermodynamic ModelingEngineeringPhysics +9