Molecular-dynamics simulations of molten Ni-based superalloys

Keyphrases

• Ab Initio Molecular Dynamics Simulation 60%
• Alloy Chemistry 20%
• Atomic Distribution 20%
• Binary Alloy 20%
• CMSX-4 40%
• Defect Formation 20%
• Density Contrast 20%
• Density Functional Theory 20%
• Density Inversion 40%
• Density-dependent Diffusion 20%
• Diffusion Rate 40%
• Directional Solidification 20%
• First-principles Method 20%
• In Alloy 20%
• Liquid Metal Alloy 40%
• Local Order 20%
• Molar Volume 100%
• Molecular Dynamics Simulation 100%
• Mushy Zone 40%
• Ni-based Superalloy 100%
• Simple Metals 20%
• Simulation Calculation 20%
• Simulation Prediction 20%
• Solidification Processing 20%
• Thermal Expansion 20%
• Underlying Assumptions 20%
• Volume Density 20%
• W-Re 20%
• W-Ta 20%

Engineering

• Alloy 40%
• Binary Alloy 20%
• Computer Simulation 100%
• Defects 20%
• Directional Solidification 20%
• Experimental Measurement 20%
• Good Agreement 20%
• Illustrates 20%
• Liquid Metal 40%
• Molar Volume 100%
• Mushy Zone 40%
• Ni Alloy 20%

Material Science

• Alloy 33%
• Binary Alloy 16%
• Density 100%
• Density (Specific Gravity) 83%
• Liquid Metal 33%
• Nickel-Based Superalloys 100%
• Solidification 33%
• Thermal Expansion 16%