Identification and characterization of L-, D- and DL- penicillamine were demonstrated by Terahertz time-domain spectroscopy (THz-TDS). To understand the physical origins of the low frequency resonant modes, the densit...Identification and characterization of L-, D- and DL- penicillamine were demonstrated by Terahertz time-domain spectroscopy (THz-TDS). To understand the physical origins of the low frequency resonant modes, the density functional theory (DFT) was adopted for theoretical calculation. It was found that the collective THz frequency motions were decided by the intramolecular and intermolecular hydrogen bond interactions. Moreover, the quantification of penicillamine enantiomers mixture was demonstrated by a THz spectra fitting method with a relative error of less than 3.5%. This technique can be a valuable tool for the discrimination and quantification of chiral drugs in pharmaceutical industry.展开更多
The optical and electrical properties of several composites, formed by filling the high density polyethylene (HDPE) with similar amount of carbon black (CB), multi-walled carbon nanotubes (MWNT) and fullerene (C60), r...The optical and electrical properties of several composites, formed by filling the high density polyethylene (HDPE) with similar amount of carbon black (CB), multi-walled carbon nanotubes (MWNT) and fullerene (C60), respectively, were characterized using a THz-TDS setup. It was found that the optical parameters and the details of their variation with frequency differ significantly for different kinds of carbon materials. The results are analyzed by using Cole-Cole formula of dipole relaxation under the assumption that carbon particles dispersed in the matrix behave like dipoles and contribute mainly to the dielectric loss in the THz frequency range. Fitting results indicate that MWNT and CB filled composites have a broader distribution of the relaxation time compared with C60 which possesses a nearly single relaxation time. Compared with CB and C60, MWNT filled composite possesses the larger relaxation strength due to its higher electron density and larger conductive clusters. The real part of conductivity for three kinds of composites all follows power law behavior with respect to frequency but the exponents are quite different. These phenomena may be related to the special properties of the fillers as well as their particulate structures, such as aspect ratio, particle size, and aggregate structure, etc.展开更多
基金Supported by National Natural Science Foundation of China (No.60907044)the Major State Basic Research Development Program in China (No.2010CB834301)+1 种基金Chinese Academy of Sciences Key Project of International Co-operation (No.GJHZ09058)Science Foundation of the Chinese Academy of Sciences
文摘Identification and characterization of L-, D- and DL- penicillamine were demonstrated by Terahertz time-domain spectroscopy (THz-TDS). To understand the physical origins of the low frequency resonant modes, the density functional theory (DFT) was adopted for theoretical calculation. It was found that the collective THz frequency motions were decided by the intramolecular and intermolecular hydrogen bond interactions. Moreover, the quantification of penicillamine enantiomers mixture was demonstrated by a THz spectra fitting method with a relative error of less than 3.5%. This technique can be a valuable tool for the discrimination and quantification of chiral drugs in pharmaceutical industry.
基金Supported by the National Natural Science Foundation of China (Contract No.10675157)
文摘The optical and electrical properties of several composites, formed by filling the high density polyethylene (HDPE) with similar amount of carbon black (CB), multi-walled carbon nanotubes (MWNT) and fullerene (C60), respectively, were characterized using a THz-TDS setup. It was found that the optical parameters and the details of their variation with frequency differ significantly for different kinds of carbon materials. The results are analyzed by using Cole-Cole formula of dipole relaxation under the assumption that carbon particles dispersed in the matrix behave like dipoles and contribute mainly to the dielectric loss in the THz frequency range. Fitting results indicate that MWNT and CB filled composites have a broader distribution of the relaxation time compared with C60 which possesses a nearly single relaxation time. Compared with CB and C60, MWNT filled composite possesses the larger relaxation strength due to its higher electron density and larger conductive clusters. The real part of conductivity for three kinds of composites all follows power law behavior with respect to frequency but the exponents are quite different. These phenomena may be related to the special properties of the fillers as well as their particulate structures, such as aspect ratio, particle size, and aggregate structure, etc.
