First-principles study of multiple-site substitutions of alloying elements in Ni-based single crystal superalloys
Junxi Sun, Wan Du, Bin Xiao, Yuqin Wu, Yi Liu, Tong‐Yi Zhang
Topics & Concepts
Materials scienceDopingTransition metalSuperalloyDensity functional theoryCrystallographyCrystal structureNickelSingle crystalMetalCrystal (programming language)MetallurgyAlloyComputational chemistryChemistryCatalysisBiochemistryComputer scienceOptoelectronicsProgramming languageHigh Temperature Alloys and CreepAdvanced Materials Characterization TechniquesIntermetallics and Advanced Alloy Properties