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An informatics approach to transformation temperatures of NiTi-based shape memory alloys
The Interaction of Dislocations and Hydrogen-vacancy Complexes and Its Importance for Deformation- induced Proto Nano-voids Formation in α-Fe
Modeling the strengthening response to aging process of heat-treatable aluminum alloys containing plate/disc- or rod/needle-shaped precipitates
Anisotropic shock response of titanium: Reorientation and transformation mechanisms
The evolving quality of frictional contact with graphene
Atomistic simulations reproduce the experimental observations of layer-dependent friction and transient frictional strengthening on graphene and reveal that the evolution of static friction is a manifestation of the natural tendency for thinner and less-constrained graphene to re-adjust its configuration as a direct consequence of its greater flexibility.
Phase selection rule for Al-doped CrMnFeCoNi high-entropy alloys from first-principles
Origin of 2-stage R-phase transformation in low-temperature aged Ni-rich Ti–Ni alloys
Thermally activated avalanches: Jamming and the progression of needle domains
Large-scale computer simulations of a simple model with a square-lattice topology, a small shear deformation (4° shear angle), and open (free) boundary conditions show that domain boundary movements…
Collective nature of plasticity in mediating phase transformation under shock compression
processes such as twinning or dislocations accompanying a phase change, and modes that can become active only in extreme environments. We show that a deformation mode not present in static conditions…
Accelerated Discovery of Large Electrostrains in BaTiO3‐Based Piezoelectrics Using Active Learning
It is shown how the use of machine learning coupled to optimization methods can accelerate the discovery of new Pb-free BaTiO3 (BTO-) based piezoelectrics with large electrostrains with Landau theory and insights from density functional theory.