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First-principles calculations of (0 0 1)-Al//(0 0 1) interface in Al-Cu alloys: Atomic structure, bonding strength, stability and electronic properties

Xiangkai Chen, Xiaohua Chen, Zidong Wang, Jian Yang, Kaixuan Chen, Yanlin Wang

2022Computational Materials Science11 citationsDOI

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StackingMaterials scienceSurface energyElectronic structureDensity functional theoryUltimate tensile strengthStability (learning theory)Bonding strengthCharge densityStructural stabilityCrystallographyChemistryComputational chemistryComposite materialStructural engineeringPhysicsOrganic chemistryMachine learningEngineeringComputer scienceQuantum mechanicsAluminum Alloys Composites PropertiesAluminum Alloy Microstructure PropertiesMicrostructure and mechanical properties
First-principles calculations of (0 0 1)-Al//(0 0 1) interface in Al-Cu alloys: Atomic structure, bonding strength, stability and electronic properties | Litcius