Machine-learning potentials for crystal defects
Decades of advancements in strategies for the calculation of atomic interactions have
culminated in a class of methods known as machine-learning interatomic potentials …
culminated in a class of methods known as machine-learning interatomic potentials …
Atomic faulting induced exceptional cryogenic strain hardening in gradient cell–structured alloy
Coarse-grained materials are widely accepted to display the highest strain hardening and
the best tensile ductility. We experimentally report an attractive strain hardening rate …
the best tensile ductility. We experimentally report an attractive strain hardening rate …
Maximum strength and dislocation patterning in multi–principal element alloys
P Cao - Science advances, 2022 - science.org
Multi–principal element alloys (MPEAs) containing three or more components in high
concentrations render a tunable chemical short-range order (SRO). Leveraging large-scale …
concentrations render a tunable chemical short-range order (SRO). Leveraging large-scale …
[HTML][HTML] Structural modelling and mechanical behaviors of graphene/carbon nanotubes reinforced metal matrix composites via atomic-scale simulations: A review
C Qiu, Y Su, J Yang, B Chen, Q Ouyang… - Composites Part C: Open …, 2021 - Elsevier
Due to their excellent mechanical properties including high modulus, high strength, large
ductility and low density, nanocarbon like the graphene (Gr) and carbon nanotubes (CNTs) …
ductility and low density, nanocarbon like the graphene (Gr) and carbon nanotubes (CNTs) …
Dislocation interactions during plastic relaxation of epitaxial colloidal crystals
The severe difficulty to resolve simultaneously both the macroscopic deformation process
and the dislocation dynamics on the atomic scale limits our understanding of crystal …
and the dislocation dynamics on the atomic scale limits our understanding of crystal …
Atomistic simulation of the shock wave in copper single crystals with pre-existing dislocation network
IA Bryukhanov - International Journal of Plasticity, 2022 - Elsevier
We present molecular dynamics simulations of shock compression and spall fracture in [111]
copper single crystals with pre-existing dislocations. Shock waves are simulated for an …
copper single crystals with pre-existing dislocations. Shock waves are simulated for an …
Crystal plasticity model of BCC metals from large-scale MD simulations
Accurate crystal plasticity models that faithfully capture the behavior of single crystals under
a wide range of loading conditions, such as loading direction, strain rate, and temperature …
a wide range of loading conditions, such as loading direction, strain rate, and temperature …
A broad study of tantalum strength from ambient to extreme conditions
By combining experiments and modeling from three US national laboratories, we explore
compressive strength in a well-characterized material, tantalum, across pressures from zero …
compressive strength in a well-characterized material, tantalum, across pressures from zero …
A crystal plasticity based strain rate dependent model across an ultra-wide range
Numerous studies have investigated the strain rate sensitive behaviors of materials,
consistently reporting enhanced stress values and increased dislocation density with rising …
consistently reporting enhanced stress values and increased dislocation density with rising …
Dislocation mediated dynamic tension-compression asymmetry of a Ni2CoFeV0. 5Mo0. 2 medium entropy alloy
Although tension-compression (TC) asymmetry in yield strength was rarely documented in
coarse-grained face centered cubic (FCC) metals as critical resolved shear stress (CRSS) …
coarse-grained face centered cubic (FCC) metals as critical resolved shear stress (CRSS) …