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101.
In this work, we used density functional theory with the Tkatchenko and Scheffler method to investigate the adsorption of diazinon, hinosan, chlorpyrifos, and parathion organophosphorus pesticides on the surface of B36N36 nanocage and its Fe doped derivatives. The assessments revealed that van der Waals interaction is a key factor in organophosphate adsorption on the surface of these nanocages as well as overlapping. The results of Fukui indices and atomic partial charges calculations indicated that these pesticides and nanocages act as nucleophile and electrophile, respectively, and the adsorption sites of all four organophosphates on these nanocages are thiophosphate groups, as well as the aromatic ring in diazinon, and the nitro group in parathion. In addition, the calculated adsorption energies yielded the best result for diazinon, and the best Fe doped B36N36 derivative for adsorbing organophosphates in aqueous solution is the one in which Fe atom is located in the boron position of the square ring of B36N36. 相似文献
102.
Mubasher Jamil Kuralay Yesmakhanova Davood Momeni Ratbay Myrzakulov 《Central European Journal of Physics》2012,10(5):1065-1071
In this paper, we examine the interacting dark energy model in f(T) cosmology. We assume dark energy as a perfect fluid and choose a specific cosmologically viable form f(T) = ????T. We show that there is one attractor solution to the dynamical equation of f(T) Friedmann equations. Further we investigate the stability in phase space for a general f(T) model with two interacting fluids. By studying the local stability near the critical points, we show that the critical points lie on the sheet u* = (c ? 1)v* in the phase space, spanned by coordinates (u, v, ??, T). From this critical sheet, we conclude that the coupling between the dark energy and matter c ?? (?2, 0). 相似文献
103.
The electrochemical oxidation of iodide ion in the presence of 4-hydroxycoumarin (1) was studied using cyclic voltammetry and controlled-potential coulometry. The result indicates that the resulting iodine takes part in a halogenation reaction and reacts with 4-hydroxycoumarin (1). According to the obtained results, a new and simple coulometric titration method with potentiometric end-point detection for the determination of 4-hydroxycoumarin (1) is presented. In the presented method, 2-200 micromol of 4-hydroxycoumarin (1) was successfully determined. 相似文献
104.
Reza Rezavand Massoud Amini Mohammad Hossein Sattari Davood Ebrahimi Bagha 《Semigroup Forum》2008,77(2):300-305
We extend the concept of Arens regularity of a Banach algebra
to the case that there is an
-module structure on
, and show that when S is an inverse semigroup with totally ordered subsemigroup E of idempotents, then A=ℓ
1(S) is module Arens regular if and only if an appropriate group homomorphic image of S is finite. When S is a discrete group, this is just Young’s theorem which asserts that ℓ
1(S) is Arens regular if and only if S is finite.
An erratum to this article can be found at 相似文献
105.
In this work, an experimental study of spray impact onto a horizontal flat and rigid surface is presented. The phase Doppler
technique has been used to characterize both the impacting and the secondary spray in terms of mass and number flux, size
distribution and velocities of the droplets above the target. A high-resolution CCD camera has been used to measure the average
liquid film thickness formed due to spray impact, whereas a high-speed CMOS camera has been used to characterize the splashing
droplets from the wall. This visualization of the splashing phenomenon and the knowledge about the liquid film thickness are
used to formulate a new physical model of the crown evolution. Furthermore, information about the incident-to-ejected mass
fraction and number fraction are novel contributions of this study. Considerable data are provided comparing the impact of
single drops onto a liquid film to impact of drops in a spray, and the significance of the observed differences for modelling
efforts is discussed. The measurements of this study are also shown to be rather sensitive to the placement of the phase Doppler
measurement volume above the surface and to the operating parameters of the instrument. These effects have been documented
and discussed for this particular measurement situation. 相似文献
106.
An experimental study of spray impact onto horizontal flat and rigid surfaces is presented and used as input data for a new empirical model. A phase Doppler instrument has been used to measure drop size and two components of velocity directly above the target. The average film thickness formed due to spray impact has been measured using a high-speed CCD camera. The spray–wall interaction has been characterized in terms of correlations for the velocity and trajectory of secondary droplets and the mass and number ratio of the secondary spray. The novel aspect of the model is that the correlations are based on mean statistics over many events and not on the outcome of single drop impact experiments. Furthermore a rather large range of oblique impact angles have been studied and incorporated into the empirical models as an influencing factor. 相似文献
107.
Miansari Mehdi Aghajani Hossein Zarringhalam Majid Toghraie Davood 《Journal of Thermal Analysis and Calorimetry》2021,144(1):179-187
Journal of Thermal Analysis and Calorimetry - Present work studies the effects of microchannel height and Reynolds number on the temperature distribution behavior, pressure drop, and Nusselt number... 相似文献
108.
Fe3O4-supported copper (II) Schiff-Base complex has been synthesized through post-modification with 1,3-phenylenediamine followed by further post-modification with salicylaldehyde and coordination with Cu(II) ion. The resulted Fe3O4@SiO2-imine/phenoxy-Cu(II) magnetic nanoparticles (MNPs) were characterized by various techniques including SEM, TEM, XRD, XPS, EDX, VSM, FT-IR, and ICP. The catalytic activity as a magnetically recyclable heterogeneous catalyst for one-pot, three-component synthesis of 2-amino-4H-chromene derivatives was examined. The catalyst is efficient in the reaction and can be recovered by magnetic separation and recycled several times without significant loss in the catalytic activity. 相似文献
109.
Rajarama Mohan Jena Snehashish Chakraverty Hadi Rezazadeh Davood Domiri Ganji 《Mathematical Methods in the Applied Sciences》2020,43(7):3903-3913
Fractional Brusselator reaction-diffusion system (BRDS) is used for modeling of specific chemical reaction-diffusion processes. It may be noted that numerous models in nonlinear science are defined by fractional differential equations (FDEs) in which an unknown function appears under the operation of a fractional-order derivative. Even though many researchers have studied the applicability and practicality of this model, the analytical approach of this model is rarely found in the literature. In this investigation, a novel semi-analytical technique called fractional reduced differential transform method (FRDTM) has been applied to solve the present model, which is characterized by the time-fractional derivative (FD). Obtained outcomes are compared with the solution of other existing methods for a particular case. Also, the convergence analysis of this model has been studied here. 相似文献
110.
Hamid Hashemi-Moghaddam Davood Jamal Jedi 《International journal of environmental analytical chemistry》2015,95(1):33-44
A monolithic solid-phase microextraction (SPME) fibre was fabricated based on a molecularly imprinted polymer that could be coupled with gas chromatography for extraction, and determination of chlorpyrifos. The time of extraction, pH, temperature and ionic strength were investigated as important factors on the extraction procedure. The fabricated fibre was firm, inexpensive, stable and selective which gave it vital importance in SPME. The selectivity of the fabricated fibre in relation to analogue compounds was also investigated. Under the optimum conditions, the calibration curve was linear in the range of 1–20 mg L?1 (R2 = 0.9899). The high extraction efficiency was obtained for chlorpyrifos with a detection limit of 0.23 mg L?1. The fabricated fibre was successfully applied to SPME of chlorpyrifos from apple and grape fruits after its extraction and followed by gas chromatography-flame ionisation detector analysis. 相似文献