Molecular dynamics with quantum forces: Vibrational spectra of localized systems

Physics & Astronomy

• vibrational spectra 71%
• grids 51%
• molecular dynamics 45%
• molecules 33%
• pseudopotentials 31%
• vibration mode 28%
• plane waves 26%
• simulation 24%
• silicon 16%

Engineering & Materials Science

• Vibrational spectra 100%
• Molecular dynamics 71%
• Molecules 61%
• Computer simulation 34%
• Finite difference method 31%
• Silicon 24%

Chemical Compounds

• Vibrational Spectrum 61%
• Molecular Dynamics 46%
• Force 42%
• Molecular Cluster 41%
• Pseudopotential 40%
• Simulation 39%
• Molecule 22%
• Time 11%