Keyphrases
Solute
100%
Dislocation Core
52%
Dislocation
51%
Density Functional Theory
47%
Rutile
44%
First-principles
43%
Magnesium
34%
Ni-based Superalloy
32%
First-principles Calculations
29%
Transport Coefficients
28%
Screw Dislocation
26%
Lattice Green's Function
26%
Materials Science
25%
Martensitic Transformation
24%
Diffusivity
24%
Ab Initio Molecular Dynamics Simulation
22%
Flexible Boundary Conditions
22%
Molar Volume
22%
Embedded Atom Method
21%
Material Engineering
20%
Oxygen Interstitials
19%
Edge Dislocation
19%
Solute Transport
18%
Lattice Parameter
18%
Elastic Stiffness Coefficients
18%
Molecular Dynamics Simulation
18%
Core Structure
17%
Onsager Matrix
16%
Hexagonal Close-packed
16%
Density Functional Calculations
16%
Cross-slip
16%
Classical Potential
16%
Screw
15%
Palladium
14%
Interatomic Potential
14%
Binary Alloy
14%
Solid Solution
14%
Energy Barrier
14%
Heteroepitaxial Structures
13%
Vacancy-mediated Diffusion
13%
Oxygen Diffusion
13%
Solute Drag
12%
Energy Density
12%
Computational Module
12%
Solute Atoms
11%
Migration Barrier
11%
Database Optimization
11%
Phase Stability
11%
Interstitial Site
11%
Kinetic Monte Carlo
11%
Engineering
Dislocation Core
53%
Green Function
46%
Defects
41%
Energy Engineering
36%
Diffusivity
31%
Boundary Condition
27%
Computer Simulation
25%
Solid Solution
21%
Screw Dislocation
20%
Hexagonal Close Packed
19%
Dislocation Interaction
18%
Lattice Parameter
18%
Elastic Stiffness
18%
Stacking Fault Energy
18%
Interstitial Oxygen
15%
Face-Centered Cubic
14%
Energetics
14%
Strain Field
12%
Interstitial Site
12%
Molar Volume
12%
Energy Barrier
12%
Edge Dislocation
11%
Diffusion Barrier
11%
Cross Slip
11%
Mediated Transport
10%
Size Effect
10%
Mesoscale
10%
Activation Energy
9%
Solute Transport
9%
Packed Metal
9%
Drag Ratio
9%
Diffusion Mechanism
9%
Peierls Stress
9%
Effect of Strain
9%
Energy Density
9%
Phase Stability
9%
Yield Strength
9%
Ambient Pressure
9%
Interaction Energy
8%
Plastic Deformation
8%
Liquid Metal
8%
Room Temperature
7%
Diffusion Coefficient
7%
Solute Concentration
7%
Metastable Phase
7%
Error Estimation
6%
Density Method
6%
Multiscale
6%
Prism Plane
6%
Engineering
6%
