Density functional theory studies of quantum transport in molecular systems

Keyphrases

• Molecular Systems 100%
• Density Functional Theory 100%
• Quantum Transport 100%
• Organic Molecules 100%
• Quantum Chemical Calculations 50%
• Electronic Structure Calculations 50%
• Carbon Nanotubes 50%
• Nonequilibrium Green's Function 50%
• Quantum Conductance 50%
• Electronic Devices 50%
• Molecular Structure 50%
• Innovative Approach 50%
• Quantum Mechanical Methods 50%
• Quantum Electronics 50%
• Molecule Structure 50%
• Algorithm Performance 50%
• Realist Evaluation 50%
• High Performance Computing 50%
• Numerical Algorithms 50%
• Multiple Disciplines 50%
• Physical Limits 50%
• Electron Transport Properties 50%
• Molecular Electronics 50%
• Property Evaluation 50%
• Functional Electronics 50%
• Green's Function Theory 50%
• Semiconducting Device 50%

Physics

• Carbon Nanotube 100%
• Molecular Structure 100%
• Transport Property 100%
• Quantum Transport 100%
• Green's Functions 100%
• Energy Levels 100%
• Molecular Electronics 100%
• Quantum Electronics 100%
• Density Functional Theory Study 100%

Material Science

• Electronic Circuit 100%
• Density 100%
• Carbon Nanotube 100%
• Electronic Structure Calculation 100%
• Electron Transfer 100%
• Molecular Structure 100%