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Atomic-scale understanding of oxide growth and dissolution kinetics of Ni-Cr ...
Passivation oxide formation is the key for corrosion control of metal alloys. The kinetics of competing oxide formation and dissolution determines alloy corrosion behaviors in... -
First-principles thermodynamics of precipitation in aluminum-containing refra...
Materials for high-temperature environments are actively being investigated for deployment in aerospace and nuclear applications. This study uses computational approaches to... -
Training sets based on uncertainty estimates in the cluster-expansion method
Cluster expansion (CE) has gained an increasing level of popularity in recent years, and many strategies have been proposed for training and fitting the CE models to...
