Describing metal surfaces and nanostructures with orbital-free density functional theory

Keyphrases

• Extended Surfaces 50%
• Kinetic Energy Density Functional 50%
• Metal Nanostructures 100%
• Metal Surface 100%
• Nanoindentation 50%
• Nanoparticles 50%
• Nanowires 50%
• Orbital-free Density Functional Theory 100%
• Property Prediction 50%
• Pseudopotential 50%
• Quantum Mechanics 50%
• Simple Metals 50%
• Structural Properties 50%

Material Science

• Density 100%
• Energy Density 50%
• Metal Surface 100%
• Nanocrystalline Material 100%
• Nanoindentation 50%
• Nanoparticle 50%
• Nanowire 50%
• Structural Property 50%

Chemistry

• Density Functional Theory 100%
• Kinetic Energy 50%
• Nanomaterial 100%
• Nanoparticle 50%
• Nanowires 50%
• Pseudopotential 50%
• Quantum Mechanics 50%
• Structure 50%