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Selected Recent Publications in Computational Materials Science
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From the Femtoscale to the Mesoscale and Back: An Integrated Multiscale Approach

From the Femtoscale to the Mesoscale and Back: An Integrated Multiscale Approach

Polyvalent Machine-Learned Potential for Cobalt: from Bulk to Nanoparticles

Polyvalent Machine-Learned Potential for Cobalt: from Bulk to Nanoparticles

Sorption and Diffusion of Small Gas Molecules in Semicrystalline Models: A Molecular-Scale Investigation

Sorption and Diffusion of Small Gas Molecules in Semicrystalline Models: A Molecular-Scale Investigation
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