scholarly journals Cellulose-Based Hectocycle Nanopolymers: Synthesis, Molecular Docking and Adsorption of Difenoconazole from Aqueous Medium

2021 ◽  
Vol 22 (11) ◽  
pp. 6090
Author(s):  
Bayan Khalaf ◽  
Othman Hamed ◽  
Shehdeh Jodeh ◽  
Roland Bol ◽  
Ghadir Hanbali ◽  
...  
Keyword(s):  
Md Simulation ◽  
High Efficiency ◽  
Adsorption Process ◽  
Adsorption Sites ◽  
Carbonyl Chloride ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Kinetic And Thermodynamic Studies ◽  
Ft Ir Spectroscopy

The goal of this work was to develop polymer-based heterocycle for water purification from toxic pesticides such as difenoconazole. The polymer chosen for this purpose was cellulose nanocrystalline (CNC); two cellulose based heterocycles were prepared by crosslinking with 2,6-pyridine dicarbonyl dichloride (Cell-X), and derivatizing with 2-furan carbonyl chloride (Cell-D). The synthesized cellulose-based heterocycles were characterized by SEM, proton NMR, TGA and FT-IR spectroscopy. To optimize adsorption conditions, the effect of various variable such as time, adsorbent dose, pH, temperature, and difenoconazole initial concentration were evaluated. Results showed that, the maximum difenoconazole removal percentage was about 94.7%, and 96.6% for Cell-X and Cell-D, respectively. Kinetic and thermodynamic studies on the adsorption process showed that the adsorption of difenoconazole by the two polymers is a pseudo-second order and follows the Langmuir isotherm model. The obtained values of ∆G ° and ∆H suggest that the adsorption process is spontaneous at room temperature. The results showed that Cell-X could be a promising adsorbent on a commercial scale for difenoconazole. The several adsorption sites present in Cell-X in addition to the semi crown ether structure explains the high efficiency it has for difenoconazole, and could be used for other toxic pesticides. Monte Carlo (MC) and Molecular Dynamic (MD) simulation were performed on a model of Cell-X and difenoconazole, and the results showed strong interaction.

scholarly journals Eggshell Powder as an Adsorbent for Removal of Fluoride from Aqueous Solution: Equilibrium, Kinetic and Thermodynamic Studies

2012 ◽  
Vol 9 (3) ◽  
pp. 1457-1480 ◽  
Author(s):  
R. Bhaumik ◽  
N. K. Mondal ◽  
B. Das ◽  
P. Roy ◽  
K. C. Pal ◽  
...  
Keyword(s):  
Aqueous Solution ◽  
Adsorption Process ◽  
Low Cost ◽  
Fluoride Removal ◽  
Contaminated Water ◽  
Fluoride Adsorption ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order ◽  
Kinetic And Thermodynamic Studies ◽  
Maximum Removal

A new medium, eggshell powder has been developed for fluoride removal from aqueous solution. Fluoride adsorption was studied in a batch system where adsorption was found to be pH dependent with maximum removal efficiency at 6.0. The experimental data was more satisfactorily fitted with Langmuir isotherm model. The kinetics and the factor controlling adsorption process fully accepted by pseudo-second-order model were also discussed. Eawas found to be 45.98 kJmol-1by using Arrhenius equation, indicating chemisorption nature of fluoride onto eggshell powder. Thermodynamic study showed spontaneous nature and feasibility of the adsorption process with negative enthalpy (∆H0) value also supported the exothermic nature. Batch experiments were performed to study the applicability of the adsorbent by using fluoride contaminated water collected from affected areas. These results indicate that eggshell powder can be used as an effective, low-cost adsorbent to remove fluoride from aqueous solution as well as groundwater.

scholarly journals Adsorption of nicotine from aqueous solutions on montmorillonite and acid-modified montmorillonite

2019 ◽  
Vol 51 (1) ◽  
pp. 93-100
Author(s):  
Irena Ilic ◽  
Natasa Jovic-Jovicic ◽  
Predrag Bankovic ◽  
Zorica Mojovic ◽  
Davor Loncarevic ◽  
...  
Keyword(s):  
Isotherm Model ◽  
Kinetics Of Adsorption ◽  
Nicotine Concentration ◽  
Ph Values ◽  
Modified Montmorillonite ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Kinetics Of ◽  
Ft Ir Spectroscopy

Montmorillonite (Mt) and acid modified montmorillonite (MtA) were tested as nicotine adsorbents. The samples were characterized using FT-IR spectroscopy and low temperature nitrogen physisorption. Nicotine adsorption was performed with respect to contact time, pH and initial nicotine concentration. The kinetics of adsorption obeyed the pseudo-second-order kinetics. The optimal pH values for nicotine adsorption were 6 and 9 for Mt and MtA, respectively. The isotherms related to adsorption on Mt at pH = 6 and 9 as well as for MtA at pH=6 were best fitted with Sips isotherm model, while adsorption onto MtA at pH=9 obeyed Langmuir isotherm model.

Adsorption of Cu(II), Ni(II) and Zn(II) ions by nano kaolinite: Thermodynamics and kinetics studies

2019 ◽  
Author(s):  
Chem Int
Keyword(s):  
Metal Ions ◽  
Metal Ion ◽  
Adsorption Process ◽  
Ion Concentration ◽  
Order Kinetic ◽  
Adsorption Data ◽  
Order Kinetic Model ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order ◽  
Ft Ir

An easy route for preparation emulsion of kaolinite (Al2Si2O5.4H2O) from Sweileh sand deposits, west Amman, Jordan by hydrochloric acid under continuous stirring for 4 h at room temperature was performed and nano kaolinite powder was used as an adsorbent for the removal of Cu(II), Zn(II) and Ni(II) ions. Nano kaolinite was characterized by XRD, FT-IR and SEM techniques. Effect of pH, adsorbent dose, initial metal ion concentration, contact time and temperature on adsorption process was examined. The negative values of ΔGo and the positive value of ΔHo revealed that the adsorption process was spontaneous and endothermic. The Langmuir isotherm model fitted well to metal ions adsorption data and the adsorption capacity. The kinetic data provided the best correlation of the adsorption with pseudo-second order kinetic model. In view of promising efficiency, the nano kaolinite can be employed for heavy metal ions adsorption.

scholarly journals Kinetic and Thermal Studies of Adsorption of Allura Red Dye by Surface Functionalized Magnetite Nanoparticles

2021 ◽  
Vol 33 (11) ◽  
pp. 2675-2684
Author(s):  
Jaiveer Singh ◽  
Arti Jangra ◽  
Keerti Rani ◽  
Parvin Kumar ◽  
Suresh Kumar ◽  
...  
Keyword(s):  
Magnetite Nanoparticles ◽  
Adsorption Process ◽  
Thermal Studies ◽  
Allura Red ◽  
Langmuir Adsorption ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Coprecipitation Technique ◽  
Red Dye ◽  
Ft Ir Spectroscopy

In the present study, chitosan functionalized magnetite nanoparticles (CS@MNPs) were synthesized by a simple and economical coprecipitation technique for efficient magnetic removal of allura red dye (ARD) by adsorption technique from the aqueous solution. Size and surface properties of the bare and surface functionalized MNPs were determined with the help of XRD and TEM technique. Surface functionalization of the bare MNPs was confirmed with the help of FT-IR spectroscopy and TGA techniques. Magnetic properties of the synthesized bare and functionalized MNPs were determined by VSM technique. The effect of various parameters including adsorbent dosages, contact time, temperature on adsorption capacity of the CS@MNPs for allura red dye were investigated with the help of UV-vis spectrophotometer. The pseudo second order kinetics and Langmuir adsorption isotherm model were found to fitted well with the adsorption process of dye onto the chitosan functionalized magnetite nanoparticles (CS@MNPs).

Nano-ZrO2/TiO2 Impregnated Orange Wood Sawdust and Peach Stone Shell Adsorbents for Cr (VI) Removal

2020 ◽  
Vol 16 (7) ◽  
pp. 880-892
Author(s):  
Şerife Parlayıcı ◽  
Kübra Tuna Sezer ◽  
Erol Pehlivan
Keyword(s):  
Contact Time ◽  
Ph Value ◽  
Order Kinetic ◽  
Adsorption Parameters ◽  
Wood Sawdust ◽  
Adsorption Data ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Equilibrium Status

Background: In this work, Cr (VI) adsorption on nano-ZrO2๏TiO2 impregnated orange wood sawdust (Zr๏Ti/OWS) and nano-ZrO2๏TiO2 impregnated peach stone shell (Zr๏Ti/PSS) was investigated by applying different adsorption parameters such as Cr (VI) concentrations, contact time, adsorbent dose, and pH for all adsorbents. Methods: The adsorbents were characterized by SEM and FT-IR. The equilibrium status was achieved after 120 min of contact time and optimum pH value around 2 were determined for Cr (VI) adsorption. Adsorption data in the equilibrium is well-assembled by the Langmuir model during the adsorption process. Results: Langmuir isotherm model showed a maximum adsorption value of OWS: 21.65 mg/g and Zr๏Ti/OWS: 27.25 mg/g. The same isotherm displayed a maximum adsorption value of PSS: 17.64 mg/g, and Zr๏Ti/PSS: 31.15 mg/g. Pseudo-second-order kinetic models (R2=0.99) were found to be the best models for describing the Cr (VI) adsorption reactions. Conclusıon: Thermodynamic parameters such as changes in ΔG°, ΔH°, and ΔS° have been estimated, and the process was found to be spontaneous.

Competitive Biosorption of Pb(II) and Cu(II) by Functionalised Micropogonias undulates Scales

2020 ◽  
Vol 13 ◽  
Author(s):  
Joshua O. Ighalo ◽  
Ibrahim O. Tijani ◽  
Oluwaseun J. Ajala ◽  
Fisayo O. Ayandele ◽  
Omodele A. Eletta ◽  
...  
Keyword(s):  
Adsorption Capacity ◽  
Low Cost ◽  
Fish Scales ◽  
Wet Impregnation ◽  
Monolayer Adsorption ◽  
Competitive Biosorption ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Best Fit

Background: Modified bio-based adsorbents from plant sources can be used for pollution remediation by adsorption due to their low cost and availability in large quantities. Objective: In this study, the competitive biosorption of Pb(II) and Cu(II) by Micropogonias undulates functionalised fish scales (FFS) was conducted. The functionalisation was done by wet impregnation with Fe2+. Method: The biosorbent was characterised by Fourier Transform Infrared Spectroscopy (FT-IR), Scanning Electron Microscopy with Energy-Dispersive X-ray Spectroscopy (SEM-EDS) and Branueur–Emmett–Teller (BET) analyses. Results: The major constituents in the FFS were calcium and phosphorus from the collagen and apatite on the scales. Optimum removal efficiency for both metals was >99% at 10 g/l dosage. It was observed that the Langmuir isotherm model and the pseudo second order kinetics model were the best fit for the experimental data. The monolayer adsorption capacity of FFS for Pb(II) and Cu(II) was observed to be 96.15 mg/g and 100 mg/g respectively. Conclusion: The study revealed that the competitive biosorption of heavy metals can be achieved (at a good adsorption capacity) using functionalised Micropogonias undulates fish scales.

scholarly journals Synthesis of Zeolite from Carbothermal Reduction Electrolytic Manganese Residue for the Removal of Macrolide Antibiotics from Aqueous Solution

Materials ◽  
2018 ◽  
Vol 11 (11) ◽  
pp. 2133 ◽  
Author(s):  
Xuli Li ◽  
Yue Zeng ◽  
Fangyuan Chen ◽  
Teng Wang ◽  
Yixin Li ◽  
...  
Keyword(s):  
Aqueous Solution ◽  
Carbothermal Reduction ◽  
Adsorption Process ◽  
Hydroxyl Group ◽  
Macrolide Antibiotics ◽  
Adsorption Sites ◽  
Electrolytic Manganese ◽  
Electrolytic Manganese Residue ◽  
Pseudo Second Order ◽  
The Fourier Transform

Zeolite analcime (EMANA) was synthesized through the hydrothermal method by using carbothermal reduction electrolytic manganese residue (CR-EMR). The structural properties of EMANA and CR-EMR were studied using various characterization techniques. After hydrothermal synthesis, the CR-EMR became super-microporous, and the surface area increased by 4.76 times than before. Among the various synthesized zeolites, 6 h-synthesized EMANA was selected as the best adsorbent for macrolide antibiotics in aqueous solution. The adsorption performance of EMANA on the adsorption capacity was examined by using various experimental parameters, such as contact time (0–24 h), initial concentration (50–300 mg/L), temperature (30–50 °C) and pH (3–13). The experimental results were also analyzed by the Langmuir and Freundlich adsorption models, with the latter obtaining better representation. The adsorption process could be described well by the pseudo-second-order model, even under a low concentration (50 mg/L). This result suggests that the adsorption process of macrolide antibiotics is due to chemisorption. According to the Fourier Transform infrared spectroscopy (FT-IR) results, the adsorption of zeolite was mainly due to its hydroxyl group, which played an important role during the adsorption process. Moreover, EMANA is more suitable for treatment of roxithromycin (ROX) than azithromycin (AZM), because ROX has more adsorption sites for the hydroxyl group.

scholarly journals A Comparative Study on The Adsorption Behavior of Congo Red on to ZnAl and ZnCr Layered Double Hydroxides

2020 ◽  
Vol 9 (2) ◽  
pp. 108-116
Author(s):  
Tarmizi Taher ◽  
◽  
Nyanyu Ummu Hani ◽  
Neza Rahayu Palapa ◽  
Risfidian Mohadi ◽  
...  
Keyword(s):  
Experimental Data ◽  
Surface Area ◽  
Adsorption Kinetics ◽  
Layered Double Hydroxides ◽  
Congo Red ◽  
Adsorption Process ◽  
Bet Surface Area ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Double Hydroxides

In this work, two synthetic layered double hydroxides (LDH) consists of Zn2+ as M2+ cation with different M3+ cation, i.e., Al3+ and Cr3+ were used as an adsorbent for Congo Red removal aqueous solution. Both Zn-Al and Zn-Cr LDH were characterized by X-ray diffraction, FT-IR, and BET surface area analyzer. The effect of contact time, initial dye concentration, and temperature were evaluated in a batch technique in order to investigate the characteristic of Congo Red adsorption onto both adsorbents. The experimental data were assessed according to the parameter of adsorption kinetics, isotherm, and thermodynamics. The results of LDH characterization showed that Zn-Al LDH has a higher interlayer distance than Zn-Cr LDH, although Zn-Cr LDH has a higher surface area. The FT-IR analysis indicated the interlayer space of both Zn-Cr and Zn-Al LDH was dominated by CO32- as the interlayer anion species. The adsorption kinetics study of Congo Red on both LDH revealed that the adsorption process followed the pseudo-second-order model. For the adsorption isotherm, the experimental data fit well with the Freundlich model rather than the Langmuir model. The thermodynamic study indicated that the adsorption process that occurred on both adsorbents was spontaneous with exothermic nature.

scholarly journals Utilization of Lapindo Volcanic Mud for Enhanced Sono-sorption Removal of Acid Orange 52

2019 ◽  
Vol 14 (1) ◽  
pp. 189
Author(s):  
Nur Hidayatul Nazirah Kamarudin ◽  
Herma Dina Setiabudi ◽  
Aishah Abdul Jalil ◽  
Siti Hazirah Adam ◽  
Nur Fatien Muhamad Salleh
Keyword(s):  
Adsorption Process ◽  
Order Equation ◽  
Reaction Engineering ◽  
Adsorption Method ◽  
Adsorption Ability ◽  
Acid Orange ◽  
Isotherm Study ◽  
Sorption Method ◽  
Langmuir Isotherm Model ◽  
Pseudo Second Order

This study applied ultrasonic irradiation technique to remove acid orange 52 (AO52) and in the meantime utilizing the potential adsorbent, Lapindo volcanic mud (LVM). LVM was collected from the erupted mud in Sidoarjo, Indonesia and calcined prior the adsorption process. Previously in another study, Lapindo was proven to be efficient for adsorption of dyes in single adsorption method. In this study, the combination of adsorption with ultrasound, or as known as sono-sorption shows that the adsorptivity increased from 95.54 mg/g to 129.5 mg/g. The isotherm study shows that this process obeyed Langmuir isotherm model with adsorption capacity of 833.33 mg/g. The enhancement of sono-sorption method as compared to conventional method is believed to be resulted from the facilitated mass transfer driven by the ultrasound, along with the adsorption ability of LVM. The kinetic study fit to the pseudo second order equation. Copyright © 2019 BCREC Group. All rights reservedReceived: 1st October 2018; Revised: 22nd December 2018; Accepted: 7th January 2019; Available online: 25th January 2019; Published regularly: April 2019How to Cite: Kamarudin, N.H.N., Setiabudi, H.D., Jalil, A.A., Adam, S.H., Salleh, N.F.M. (2019). Utilization of Lapindo Volcanic Mud for Enhanced Sono-sorption Removal of Acid Orange 52. Bulletin of Chemical Reaction Engineering & Catalysis, 14 (1): 189-195 (doi:10.9767/bcrec.14.1.3326.189-195)Permalink/DOI: https://doi.org/10.9767/bcrec.14.1.3326.189-195  

Selective Removal of Hg2+ Ions from Water Using New Functionalized Silica Resin: Equilibrium, Thermodynamics and Kinetic Modeling Studies

2021 ◽  
Vol 43 (4) ◽  
pp. 436-436
Author(s):  
Nida Shams Jalbani Nida Shams Jalbani ◽  
Amber R Solangi Amber R Solangi ◽  
Shahabuddin Memon Shahabuddin Memon ◽  
Ranjhan Junejo Ranjhan Junejo ◽  
Asif Ali Bhatti Asif Ali Bhatti
Keyword(s):  
Adsorption Capacity ◽  
Adsorption Mechanism ◽  
Solid Phase ◽  
Maximum Adsorption Capacity ◽  
Adsorption Phenomenon ◽  
Column Adsorption ◽  
Pseudo Second Order ◽  
Ft Ir ◽  
Wastewater Samples ◽  
Ft Ir Spectroscopy

In current study, the diphenylaminomethylcalix[4]arene (3) was synthesized and immobilized onto silica surface to prepare a selective, regenerable and stable resin-4. The synthesized resin-4 has been characterized by FT-IR spectroscopy, scanning electron microscopy, energy-dispersive X-ray spectroscopy (EDX) and Brunauer-Emmett-Teller (BET) techniques. To check the adsorption capacity of resin-4, the batch and column adsorption methodology were applied and it has observed that the resin-4 was selectively removed Hg2+ ions under the optimized parameters. The maximum adsorption capacity was obtained at pH 9 using 25 mg/L of resin-4. Under the optimal conditions, different equilibrium, kinetic and thermodynamic models were applied to experimental data. The results show that adsorption mechanism is chemical in nature following Langmuir model with good correlation coefficient (R2=0.999) and having 712.098 (mmol/g) adsorption capacity. The energy of calculated from D-R model suggests the ion exchange nature of the adsorption phenomenon. Dynamic adsorption experiments were conducted using Thomas model. The maximum solid phase concentration (qo) was 7.5 and rate constant was found to be 0.176 with (R2=0.938) for Hg2+ ions. The kinetic study describes that the adsorption mechanism follows pseudo second order (R2=0.999). The thermodynamic parameters such as ∆H (0.032 KJ/mol) and ∆S (0.127 KJ/mol /K) and ∆G (-5.747,-6.306, -7.027 KJ/mol) shows that the adsorption of Hg2+ ion is endothermic and spontaneous. The reusability of resin-4 was also checked and it has observed that the after 15 cycle only 1.2 % adsorption reduces. Moreover, the resin-4 was applied on real wastewater samples obtained from local industrial zone of Karachi, Sindh-Pakistan.

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