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- W1506707935 abstract "Due to special sampling growth conditions, near but not exact ∑ = 11 {332} symmetrical <110> tilt grain boundaries (STGB) facets have been observed in nickel by high resolution transmission electron microscopy (HRTEM). Their extract description cannot be ascertained from the experimental images only. With the help of atomic simulations (annealed molecular dynamics) it is possible to show that some of the most frequently observed facets correspond to the asymmetrical 2 {331}//5{111} approximant grain boundary. Besides this observed asymmetrical TGB, we have simulated a large ∑ = 363 STGB (GB plane: {13 13 5}) together with other asymmetrical and incommensurate TGBs in order to see wether their atomic structure can be deduced from the structural unit (SU) model. It seems that some valuable trends can be given by the SU model but numerical atomic calculations cannot be avoided probably because the SUs can easily be deformed in metals. Several atomic potentials have been used to check the stability of the numerically obtained atomic structure." @default.
- W1506707935 created "2016-06-24" @default.
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- W1506707935 date "2000-06-27" @default.
- W1506707935 modified "2023-09-25" @default.
- W1506707935 title "Joined Numerical and Observational Study of Complex Tilt Grain Boundaries Structures at the Atomic Level in Nickel" @default.
- W1506707935 doi "https://doi.org/10.1002/352760622x.ch37" @default.
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