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RISLaser induced fluorescence bands in the FT-Raman spectra of bioceramics
A new fluorescence band at about 1930 cm−1 has been observed in the FT-Raman spectra of some bioceramics. While a fluorescence band atabout 760 cm−1 has been already reported in the FT-Raman spectra of hydroxyapatite and related calcium phosphates...
vibrational assignment of aluminum(III) tris - acetylacetone
functionals and using the 6-31G* basis set. The calculated frequencies are compared with the solid IR and Raman spectra. All of the measured IR and Raman bands were interpreted in terms of the calculated vibrational modes. Most computed bands are predicted...
Structure and vibrational assignment of beryllium acetylacetonate
(acac). The calculated frequencies are compared with the experimental Fourier transform IR and Raman spectra. All of the measured IR and Raman bands were interpreted in terms of the calculated vibrational modes. The scaled theoretical frequencies and the structural...
Low frequency vibrational spectra and the nature of metal-oxygen bond of alkaline earth metal acetylacetonates
frequencies of Be, Mg, Ca, Sr, and Ba acetylacetonates complexes. Density functional
theory (DFT) calculations have been carried out at the B3LYP level, using LanL2DZ,
def2SVP, and mixed, GenECP, (def2SVP for ...
Vibrational assignments and structure of bis(3-amino-1- phenyl-2- buten-1-onato)copper(II) complex
The bis(3-amino-1-phenyl-2-buten-1-onato)copper(II) complex, Cu(APBO)2, has been characterized by
ab initio calculations and vibrational spectroscopic techniques. The geometry optimization are performed
at ...