A computational search for ductilizing additives to Mo

Clint B. Geller,Richard W. Smith,John E. Hack,Paul Saxe,Erich Wimmer

Scripta Materialia（2005）

Cited 25|Views5

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Abstract

The Rice–Thomson parameter has been evaluated as a computational screening tool for identifying ductilizing additives to Mo. Our results support a hypothesis that soluble additives that are hcp in their pure form weaken the Mo bcc lattice against shears in the (110) plane that are associated with bcc-to-hcp transformations.

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Key words

Refractory metals,Ductility,Phase transformations,First-principles electron theory,Rice–Thomson parameter

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