Sharif Digital Repository

Volatile organic compounds (VOCs) represent a very important class of pollutants that causes serious health effects. There is an urgent requirement to establish efficient technologies that can reduce and control VOCs. Non-thermal plasma (NTP) is an emerging technology that can decompose low concentration VOCs. However, the low efficiency and high power cost are major hindrances in its commercialization. In this work, Co–Cu with TiO2 support catalysts are prepared by using the deposition precipitation method and utilized in post-plasma catalysis for the efficient degradation of toluene selected as a model VOC. The synergistic effect of Co–Cu/TiO2 with different Co/Cu molar ratios along with... 

Lung cancer (LC) is the leading cause of cancer mortality so, the analysis of exhaled human breath has great significance for early non-invasive diagnosis. Poor selectivity and strong humidity are two bottlenecks for the application of gas sensors to exhaled breath analysis. The development of novel extractive phases for the analysis of exhaled breath by chromatography is therefore a lucrative object. Polyhedral oligomeric silsesquioxanes (POSS) are among the 3D porous materials whose unique properties make them promising coatings for solid-phase microextraction (SPME). Selective enrichment of polar or nonpolar targets depends on the pore size and functional groups on the POSSs. Herein, we... 

A gradient derived base layer extractive phase was synthesized and applied for the determination of volatile organic compounds (VOCs) in saliva samples using the headspace cooled in–tube microextraction (HS–CITME) method. The base layers from three different sols of phenyltriethoxysilane (PTES), octyltrimethoxysilane (OTMS) and methyltrimethoxysilane (MTMS) as nonpolar precursors were individually dip coated on the stainless steel wires (SSW). Then, the hydrolyzed polar precursor aminopropyltriethoxysilane (APTES) reacted with the silanol groups already formed on the surface of SSWs via controlled rate infusion (CRI) method. The presence of polar and non–polar functional groups on the... 

A superhydrophobic extractive phase was prepared and packed in a needle trap microextraction device for extraction of volatile organic compounds, followed by their determination by gas chromatography. The superhydrophobic phase was prepared by surface modification of melamine formaldehyde (MF) sponge embedded by reduced graphene oxide (rGO). The overall properties of the modified MF along with its high sorption capacity and low cost fabrication were indicative of its feasibility to be highly suitable for extraction of organic pollutants. The determined water contact angle (>150o) from the surface of melamine formaldehyde–reduced graphene oxide (MF–rGO) revealed its high affinity toward... 

The interactions between four different gas molecules (methanol, o-xylene, p-xylene and m-xylene) and Ni-decorated monolayer MoS2 were investigated by means of density functional computations to exploit its potential application as a gas sensor. The electronic properties of the Ni-decorated monolayer MoS2 and gas molecule (adsorbent–adsorbate properties) strongly depend on the Ni-decorated monolayer MoS2 structure and the molecular configuration of the adsorbate. The adsorption properties of volatile organic compound (VOC) molecules on Ni-decorated MoS2 has been studied taking into account the parameters such as adsorption energy, energy bandgap, density of states, and Mulliken charge... 

Hexagonal core–shell SiO2[–MOYI]Cl–]Ag nanoframeworks were synthesized via surface modification of hexagonal silica nanoparticles prepared from perlite (EP) as a cheap and abundant raw material. The prepared samples were well characterized by X-ray diffraction powder (XRD), energy dispersive X-ray (EDX), diffuse reflectance spectroscopy (DRS), Brunauer–Emmett–Teller (BET) specific surface area analysis, fourier transform infrared spectroscopy (FTIR), energy-dispersive X-ray spectroscopy (EDX), and transmission electron microscopy (TEM). The XRD patterns confirmed that Ag and AgCl crystalline phases were successfully loaded on the surface. The TEM images were also implied that the... 

A chemiresistive sensor is described for the lung cancer biomarker hexanal. A composite consisting of molecularly imprinted polymer nanoparticles and multiwalled carbon nanotubes was used in the sensor that is typically operated at a voltage of 4 V and is capable of selectively sensing gaseous hexanal at room temperature. It works in the 10 to 200 ppm concentration range and has a 10 ppm detection limit (at S/N = 3). The sensor signal recovers to a value close to its starting value without the need for heating even after exposure to relatively high levels of hexanal  

The aim of this study is to introduce an extractive phase based on gradient concept by continuous changing in chemical functional groups for non–targeted analysis. For this purpose, three different two–component coatings containing (3–aminopropyl)trimethoxysilane (APTES) as polar and either phenyltriethoxysilane (PTES), octyl–trimethoxysilane (OTMS) or methyltrimethoxysilane (MTMS) as nonpolar precursors were formed on the modified stainless steel wires using controlled rate infusion (CRI) method. The presence of polar and/or non–polar functional groups on the surface of substrate was evaluated by Fourier–transform infrared spectroscopy (FTIR) together with contact angles determined... 

In this study, we implement a numerical model to predict secondary organic aerosol (SOA) formation from semi- and intermediate-volatility organic compounds emitted from in-use gasoline and diesel vehicles. The model is formulated based on the volatility basis set (VBS) approach, and it accounts for OH oxidation of unspeciated low-volatility organics, which are classified by their volatility. This model incorporates SOA formation data from smog chamber and emission measurements of vehicle exhaust in a Hybrid framework to calculate the contribution of both traditional and non-traditional SOA precursors to total SOA formation observed in photo-oxidation experiments. Emission and SOA formation... 

In this study, dynamic adsorption behavior of different gaseous volatile organic compounds (VOCs) on a new modified M-MIL-101(Cr) was investigated with a great emphasis on gasoline adsorption. The M-MIL-101(Cr) was synthesized, along with comprehensive purification procedures, using a new linker to cluster molar ratio (2:1 instead of 1:1) and different modulators (i.e. HF and HNO3). All prepared adsorbents were characterized by XRD, FTIR, FE-SEM and N2 adsorption-desorption at 77 K. The results showed that surface area and pore volume of the M-MIL-101@Free (i.e. modified MIL-101(Cr) with using any modulator) which were 4293 m2/g and 2.43 cm3/g, greatly elevated up to 37.2% and 71.6% against... 

We synthesized a titanium dioxide–polyaniline core–shell nanocomposite and implemented it as an efficient sorbent for the needle-trap extraction of some volatile organic compounds from urine samples. Polyaniline was synthesized, in the form of the emeraldine base, dissolved in dimethyl acetamide followed by diluting with water at pH 2.8, using the interfacial polymerization method. The TiO2 nanoparticles were encapsulated inside the conducting polymer shell, by adapting the in situ dispersing approach. The surface characteristics of the nanocomposite were investigated by Fourier transform infrared spectrometry, scanning electron microscopy, and transmission electron microscopy. After... 

Monometallic and bimetallic supported metal oxides catalysts on γ-alumina were prepared by heterogeneous deposition-precipitation. The γ-alumina used as a support was synthesized by the sol-gel and the co-precipitation methods. Supports and catalysts were characterized by Brunauer–Emmett–Teller (BET) surface area, X-ray diffraction (XRD), field-emission scanning electron microscopy (FESEM), transmission electron microscopy (TEM), and X-ray photoelectron spectroscopy (XPS). The performance of the prepared catalysts was studied for total oxidation of toluene in air at different relative humidity and oxidation temperatures. Efficiency of bimetallic catalysts for deep oxidation of toluene was... 

In the present work, the roles of inorganic oxide nanoparticles on the extraction efficiency of polyethylene terephthalate-based nanocomposites were extensively studied. Four fiber coatings based on polyethylene terephthalate nanocomposites containing different types of nanoparticles along with a pristine polyethylene terephthalate polymer were conveniently electrospun on stainless steel wires. The applicability of new fiber coatings were examined by headspace-solid phase microextraction of some environmentally important volatile organic compound such as benzene, toluene, ethylbenzene and xylene (BTEX), as model compounds, from aqueous samples. Subsequently, the extracted analytes were... 

A highly efficient polybutylene terephthalate (PBT)-based nanocomposite containing nickel oxide nanoparticles was synthesized by electrospinning technique and used as a fiber coating for solid phase microextraction. The influential morphological parameters and capability of the prepared nanocomposite including the NiO content, the coating time, the PBT concentration and applied voltage were considered for optimization. The applicability of the synthesized fiber coating was examined by headspace solid phase micro extraction and gas chromatography mass spectrometry detection of some volatile organic compounds in aqueous samples. Among the synthesized nanocomposites and pristine PBT nanofibers,... 

An attempt was made to combine μ-solid phase extraction and headspace single drop microextraction techniques and use their advantages for trace determination of some volatile organic compounds in aqueous samples. After performing the two-step preconcentration approach, the desired analytes were determined by gas chromatography-mass spectrometry. A resorcinol-formaldehyde-based xerogel was used as the extraction medium in the μ-solid phase extraction (μ-SPE) method. Then, the extracted BTEX was eluted with a rather large amount of methanol. To remove the laborious process including solvent evaporation and further reconstitution, which is usually accompanied by loss of analytes and accuracy,... 

The main aim of this work was to assess the ability of Bayesian multivariate adaptive regression splines (BMARS) and Bayesian radial basis function (BRBF) techniques for modelling the gas chromatographic retention indices of volatile components of Artemisia species. A diverse set of molecular descriptors was calculated and used as descriptor pool for modelling the retention indices. The ability of BMARS and BRBF techniques was explored for the selection of the most relevant descriptors and proper basis functions for modelling. The results revealed that BRBF technique is more reproducible than BMARS for modelling the retention indices and can be used as a method for variable selection and... 

The volatile components of Iranian saffron were extracted using ultrasonic solvent extraction (USE) technique and then were separated and detected by gas chromatography-mass spectrometry (GC-MS). Variables affecting the extraction procedure were screened by using a 25-1 fractional factorial design and among them; sample amount, solvent volume, solvent ratio and extraction time were optimized by applying a rotatable central composite design (CCD). The optimum values of factors were: 2.38 g sample, 29.04 mL solvent, 69.23% MeOH solvent ratio and 71.8 min for the extraction time. Forty constituents were identified for Iranian saffron by GC-MS representing 90% of the total peak area. The major... 

Solid-phase microextraction (SPME) coupled to gas chromatography (GC) was applied to the extraction of phenol and some of its volatile derivatives in water samples. The SPME fiber consisted of a thin layer of polyaniline, which was electrochemically coated on a fine Pt wire. The stability of the coating was such that it could be used at temperatures as high as 325 °C, without any deterioration. The effects of various parameters affecting the extraction efficiency were studied, simultaneously. From these, optimization of the extraction temperature, extraction time, coating thickness, sample pH, salt concentration and desorption time was carried out by means of a (26-2) fractional factorial... 

Biological treatment of waste gas styrene vapor was investigated in a three-stage bench-scale biofilter. Yard waste compost mixed with shredded hard plastics in a 25:75 v/v ratio of plastics:compost was inoculated with thickened municipal activated sludge. Microbial acclimation to styrene was achieved by exposing the system to an inlet concentration (CIn) of 0.25 g m -3 styrene and an empty bed retention time (EBRT) of 360 s for 30 days. Under steady-state conditions, maximum elimination capacity (EC) obtained was 45 g m-3 h-1 at a loading rate (L) of 60 g m -3 h-1 (CIn of 2 g m-3 and EBRT of 120 s). Reduction of retention time adversely impacted the performance resulting in the maximum EC... 

The need for the control of Volatile Organic Compounds (VOCs) has led engineers to modify wastewater aeration tank systems. In this research, air recirculation has been investigated as a possible VOC control strategy for these systems. A steady-state mathematical model of VOC emission rates has been developed from the fundamentals of VOC convection, volatilization and biodegradation. This model has been used to study the effect of aeration recirculation in enhancing the biodegradation of VOCs in the system, using dichloromethane as a typical VOC. A feasibility study considering plants of various sizes is needed to compare the costs and benefits of air recirculation to other VOC control...