The influence of hydrogen core force shielding on dislocation junctions in iron
arXiv:1906.05344 · doi:10.1103/PhysRevMaterials.4.033607
Abstract
The influence of hydrogen on dislocation junctions was analysed by incorporating a hydrogen dependent core force into nodal based discrete dislocation dynamics. Hydrogen reduces the core energy of dislocations, which reduces the magnitude of the dislocation core force. We refer to this as hydrogen core force shielding, as it is analogous to hydrogen elastic shielding but occurs at much lower hydrogen concentrations. The dislocation core energy change due to hydrogen was calibrated at the atomic scale accounting for the nonlinear inter-atomic interactions at the dislocation core, giving the model a sound physical basis. Hydrogen was found to strengthen binary junctions and promote the nucleation of dislocations from triple junctions. Simulations of microcantilever bend tests with hydrogen core force shielding showed an increase in the junction density and subsequent hardening. These simulations were performed at a small hydrogen concentration realistic for bcc iron.
References in corpus (8)
- Dislocation Core Energies and Core Fields from First Principles
- Structure and Strength of Dislocation Junctions: An Atomic Level Analysis
- Mesoscopic Analysis of Structure and Strength of Dislocation Junctions in FCC Metals
- Discrete dislocation plasticity HELPs understand hydrogen effects in bcc materials
- Quantifying the effect of hydrogen on dislocation dynamics: A three-dimensional discrete dislocation dynamics framework
- The energetic and structural properties of bcc NiCu, FeCu alloys: a first-principles study
- Elastic energy of a straight dislocation and contribution from core tractions
- Geometries of edge and mixed dislocations in bcc Fe from first principles calculations