Service de Recherche en Corrosion et Comportement des Matériaux

Revisiting quantum effects on dislocation glide in bcc metals from DFT calculations and machine-learning potentials

Quantum zero-point effects have been long proposed to explain a well-known discrepancy between the low-temperature flow stresses of body-centered cubic metals and corresponding atomistic models of plastic flow. Previous investigations on quantum effects relied on empirical intera...