Grain boundary stiffness based on phase field crystal simulations

• Phase field crystal modeling with wavelet filtering is shown to be an attractive replacement for molecular dynamics simulations when evaluating grain boundary stiffness by the capillary fluctuation method. Obstacles such as iterative equilibration of grain boundary structures and repeated reconstruction of the grain boundary over extended simulations can be avoided.

Ämnesord

TEKNIK OCH TEKNOLOGIER  -- Maskinteknik -- Teknisk mekanik (hsv//swe)

ENGINEERING AND TECHNOLOGY  -- Mechanical Engineering -- Applied Mechanics (hsv//eng)

Nyckelord

Grain boundaries

Grain boundary energy

Grain boundary stiffness

Modeling

Simulation

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art (ämneskategori)

ref (ämneskategori)