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• W1963540329 abstract "Seeded batch desupersaturation experiments of paracetamol in water were monitored using in situ ATR-FTIR and in situ Raman spectroscopy. On the basis of the linear relationship between the measured signal and the concentrations of the involved components, in situ ATR-FTIR and Raman spectroscopy could be used quantitatively in a calibration-free manner to estimate the crystal growth rate of paracetamol. Using a population balance model and a nonlinear least-squares optimization routine, it was shown that by fitting the measured time-resolved ATR-FTIR spectra directly and by fitting the desupersaturation profiles obtained from these spectra combined with a previously developed calibration model, essentially the same growth rate parameters can be estimated. Very similar growth rate parameters could be obtained by fitting the measured time-resolved Raman spectra using the same population balance model. These results show that crystal growth rates can be estimated in a calibration-free manner using both in situ spectroscopic techniques, thereby avoiding lengthy calibration procedures." @default.
• W1963540329 created "2016-06-24" @default.
• W1963540329 creator A5018212759 @default.
• W1963540329 creator A5038211904 @default.
• W1963540329 date "2009-11-04" @default.
• W1963540329 modified "2023-10-09" @default.
• W1963540329 title "Estimating Crystal Growth Rates Using in situ ATR-FTIR and Raman Spectroscopy in a Calibration-Free Manner" @default.
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• W1963540329 doi "https://doi.org/10.1021/ie9008138" @default.
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