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• W2892070968 abstract "Martensitic phase transformations in palladium-titanium high-temperature shape-memory alloys (HTSMA) are studied using molecular dynamics simulations. On the basis of the second nearest-neighbor modified embedded-atom method formalism, an interatomic potential for the binary palladium-titanium system is determined by improving the unary descriptions of pure palladium. The developed interatomic potential accurately reproduces physical properties at the equiatomic composition and the resultant temperature- and stress-induced phase transformations between B2 austenite and B19 martensite structures. Subsequent large-scale molecular dynamics simulations demonstrate that the developed potential can be successfully utilized to investigate atomic details of phase transformations in nanocrystalline palladium-titanium alloys." @default.
• W2892070968 created "2018-09-27" @default.
• W2892070968 creator A5032514340 @default.
• W2892070968 creator A5072939028 @default.
• W2892070968 date "2018-11-01" @default.
• W2892070968 modified "2023-09-23" @default.
• W2892070968 title "Atomistic simulations of PdTi high-temperature shape-memory alloys" @default.
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• W2892070968 doi "https://doi.org/10.1016/j.intermet.2018.08.013" @default.
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