Comprehensive density functional theory studies of vibrational spectra of carbonates

Технические дисциплины и материаловедение

• Vibrational spectra 100%
• Density functional theory 94%
• Positive ions 78%
• Carbonates 71%
• Infrared absorption 50%
• Crystal lattices 48%
• Absorption spectra 46%
• Calcite 45%
• Raman scattering 45%
• Stretching 33%
• Crystals 31%
• Infrared radiation 27%
• Metals 20%

Химические соединения

• Wavenumber 65%
• Vibrational Spectrum 61%
• Carbonate 49%
• Aragonite 42%
• Calcite 36%
• Raman Spectrum 25%
• Absorption Spectrum 22%
• Metal Ion 19%
• Density Functional Theory 19%
• Cation 18%