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Atomistic simulations for materials engineering

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If you have a question about this talk, please contact Ms Helen Gardner.

I will describe two examples of atomic scale modelling that have connections to materials engineering: (i) investigating the minimum load and corresponding crack speed at which brittle fracture can take place, and (ii) calculating pressure-temperature phase diagrams over wide ranges of P and T from first principles without any experimental input.

This talk is part of the Engineering - Mechanics and Materials Seminar Series series.

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