A combined experimental-computational study of the compression of nanoporous gold nanoparticles

A Revised Elastic Field of An Edge Dislocation

Analyzing the material properties of ultra-high temperature ceramics using atomistic simulations and experimental comparison

Atomistic Insights into Microstructural Engineering of High Entropy and Ni-Based Superalloys Thin Films

Atomistic insights on orientation-dependent deformation mechanisms in Molybdenum: Single-crystal nanowires and polycrystals

Atomistic Simulation of dislocation-obstacle interactions in Al0.3CoCrFeNi Multi-Principal Element Alloys.

Atomistic simulation study on the deformation behaviors of nanotwined NiMo alloys

Atomistic simulations on the dynamic recrystallisation during high-velocity impact in copper

Characterizing Variants during Phase Transformation and Twinning in BCC Microstructures during Deformation and Unloading

Computational alloy design based on dislocation plasticity

Controlling dislocation motion and nanoscale plasticity in semiconductors using electric fields and illumination

CRSS for Slip in Titanium: Theoretical Predictions and In-situ Experimental Measurements

Defect Trapping Mechanisms of Helical Dislocations: Insights from Anisotropic Linear Elasticity Theory

Design of high-performance lightweight high entropy alloys using high-throughput method

Development of An Analytical Surface Energy Model for Arbitrary (hkl) Surfaces in FCC and BCC Metals and Alloys

Development of semi-empirical interatomic potential to simulate plastic deformation in Ni-Co-Cr-Y-O system

Diffusivity and mechanical response of phase boundaries

Dislocation Core Structure from Diffuse Scattering Below the Bragg Peaks

Dislocation slip in bcc Nb from large-scale molecular dynamics simulations

Effects of Geometric Parameters and Temperature on Mechanical Properties of Single-Walled Carbon Nanotubes by Molecular Dynamics Simulation

Energy dissipation mechanisms and role of porosity in shock loaded niobium: a molecular dynamics study

Evaluation of Stacking Fault Energies and Microstructure Formation in Ni-Cr-Fe Alloys using Molecular Statics and Dynamics

Experimental evidence and first-principles verification of the deformation behavior of basal twist grain boundaries in Ti

Fatigue crack propagation in Aluminum and Steel dissimilar joints: Molecular dynamics simulation and experimental validation

Finely tunable thermal expansion of NiTi by stress-induced martensitic transformation and thermomechanical training

High strength and deformable intermetallics

Identification of dislocation structures in experimental Laue microdiffraction patterns

Influence of single- and multiphase zinc-blende and wurtzite structures on thermal properties of semiconductors during ultrafast melt-quenching and deformation

Insights into the soft brittle-to-ductile transition in BCC metals using multiscale modeling

Integrating Atomistic Simulations with Experimental Characterization to Understand Dislocation Mechanisms in Nanoscale Dual-Phase Alloys

Investigating the Pressure-Temperature States during Shock Compression and Shock Release in Metals using Molecular Dynamics Simulations

Local Phase Transformation Strengthening in Ni-Base Superalloys

Mechanistic Transitions Governing Strength and Stability in Grain Boundary Segregation Strengthened Nanocrystalline Aluminum Alloys

Mobile dislocation mediated Hall-Petch and inverse Hall-Petch behaviors in nanocrystalline Al-doped boron carbide

Molecular dynamics simulation study on the phase transformation behaviors of additively manufactured shape-memory alloys

Multiscale models for materials at extreme conditions using physics-informed machine learning

Role of microstructure and strength on the development of slip localizations in polycrystals

Role of ripplocations and ripplocation boundaries on the deformation of graphite

Self-healing by amorphous shear-band recovery in crystalline Al-Sm materials

Short-range Order Hardening and Enhanced Tensile Ductility in Nanocrystalline Ag by Intercalation of Amorphous Ni-rich Nanolayers

Simulation of grain growth with Molecular Dynamics using converted experimental data

Simulation vs. Experiment: The limits of predictive models for microstructural evolution

Solid state dewetting of co-sputtered thin Mo-Cu films accompanied by phase separation

Spall strength of pure solids on the periodic table and its correlation with known thermomechanical properties

Stability of high energy faults in Ni-based superalloys

The Effect of Crystallographic Defects on the Mechanical Performance of Nano-Metamaterials

The impact of initial grain boundary structure on the properties of irradiated materials

The Intrinsic Ductile-Brittle Transition in Metals and Alloys

The origin of photo plasticity in ZnS

Transformation-assisted twin nucleation in metals

Twin Boundary Engineering in Ni-based Superalloy Thin Films

Understanding the fundamental fracture behavior in NbMoTaW and NbTaTiHf

Universal Interatomic Potential and Simulation of Kinetics

Unravel Failure Mode in Garnet-Type Solid Electrolytes from Atomistic Simulations

Validating x-ray line-profile analysis of defects in deformed metal using atomistic simulation

Virtual Diffraction as a Method to Bridge Atomistic and Mesoscale Simulations with Experiments

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