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2 Result(s)
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Article
Methodological challenges in combining quantum-mechanical and continuum approaches for materials science applications
Multi-methodological approaches combining quantum-mechanical and/or atomistic simulations with continuum methods have become increasingly important when addressing multi-scale phenomena in computational materi...
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Article
Open AccessAtomistic calculations on interfaces: Bridging the length and time scales
Phase field simulations suitable to describe interfacial phenomena at the mesoscale require as input parameters accurate interfacial energies as well as the interface mobilities. However, this information is n...
