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1.
Spectrochim Acta A Mol Biomol Spectrosc ; 309: 123868, 2024 Mar 15.
Artigo em Inglês | MEDLINE | ID: mdl-38217991

RESUMO

We introduce a new application for online Raman spectroscopy to monitor adsorption breakthrough curves of a glucose and xylose mixtures. Univariate and multivariate Partial Least Squares (PLS) calibration models are developed for each sugar when they are dissolved in water and in the case of the ethanol addition as a cosolvent. The models are validated by performing actual breakthrough experiments in a liquid phase using a column packed with a zeolite adsorbent. The first statistical moments of predicted curves are compared to the reference curves obtained with offline High-Performance Liquid Chromatography (HPLC). Glucose and xylose univariate predictions in the presence or absence of ethanol in the mixture are accurate and no improvements are found with the PLS models. Spectral subtraction coupled with the first derivative proved to be effective pretreatments to develop robust univariate models.

2.
J Am Chem Soc ; 127(33): 11600-1, 2005 Aug 24.
Artigo em Inglês | MEDLINE | ID: mdl-16104726

RESUMO

A batch technique was applied to determine the equilibrium adsorption of benzene from its benzene/octane and benzene/octene mixture on NaX (Si:Al 1.20) and NaY (Si:Al 2.79) in liquid phase. Benzene was preferentially adsorbed from both mixtures on NaX and NaY. Regardless whether octane or octene was present in the binary mixture, benzene was adsorbed more selectively on the high-silica NaY compared to NaX, which contained more cations. The presence of cations on the SIII/SIII' site inside the supercages of NaX causes a more difficult hosting of benzene inside the supercages of NaX and especially on the 12-membered ring site. However, at sufficiently high external benzene concentration (>10 mol %), the 12-membered ring site of NaX will be occupied by benzene, leading to a maximum adsorption capacity of five benzenes per supercage on both NaX and NaY. The double bond present inside octene allows the molecules to compete for the adsorption sites with benzene. The competitive effect of octene prevents the fifth benzene molecule to adsorb in the NaX supercage within the investigated concentration range.


Assuntos
Ligas/química , Zeolitas/química , Adsorção , Alumínio/química , Benzeno/química , Modelos Moleculares , Octanos/química , Silício/química , Sódio/química , Solventes/química , Propriedades de Superfície
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