Ab initio local vibrational modes of light impurities in silicon

Chemistry

• Density Matrix 71%
• Atomic Orbital 64%
• Perturbation Theory 60%
• Interstitial 54%
• Hydrogen 52%
• Vibrational Frequency 50%
• Displacement 42%
• Error 39%
• Electronic State 38%
• Molecule 36%

Physics & Astronomy

• vibration mode 94%
• impurities 68%
• hydrogen 63%
• silicon 55%
• interstitials 29%
• harmonics 23%
• defects 19%
• matrices 18%
• molecules 18%
• functionals 16%
• dimers 15%
• boron 14%
• perturbation theory 14%
• orbitals 12%
• formulations 11%
• configurations 9%
• electronics 8%

Engineering & Materials Science

• Impurities 100%
• Hydrogen 82%
• Silicon 81%
• Molecules 33%
• Electronic states 27%
• Vibrational spectra 27%
• Dimers 26%
• Defects 23%
• Vacancies 23%
• Boron 19%
• Experiments 6%