BCC Structural Stability and Deformation Behavior of Ti-Mo Alloys: A Cluster-Model-Embedded First-Principles Study
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To elucidate the intrinsic link between the body-centered cubic (BCC) structural stability and the deformation mechanisms of Ti-Mo alloys, first-principles (FP) calculations based on a cluster model are performed for Ti-xMo (x = 2.3, 4.7, 7.8, and 12.5 at. %) ... ...
