Article
Chemistry, Physical
Rachid Hsissou, Fouad Benhiba, Meriam El Aboubi, Said Abbout, Zakaria Benzekri, Zaki Safi, Mourad Rafik, Hanane Bahaj, Meriyam Kaba, Mouhsine Galai, Nuha Wazzan, Samir Briche, Said Boukhris, Abdelkader Zarrouk, Mohamed EbnTouhami, Mohamed Rafik
Summary: Ecofriendly epoxy resins derivatives GlP and GaP were synthesized and their corrosion protection properties on carbon steel were investigated. The results showed that GlP and GaP have excellent inhibitory efficiency and can effectively prevent chloride ion attack.
CHEMICAL PHYSICS LETTERS
(2022)
Article
Chemistry, Applied
M. Szocinski, K. Darowicki
Summary: This study investigated the durability of epoxy resin after 12-week exposure to UV radiation, aiming to determine the onset of epoxy degradation. Raman spectroscopy, atomic force microscopy, and electrochemical impedance spectroscopy were used to periodically inspect epoxy film on steel substrate systems. The behavior of the polymer was divided into three periods: immunity, degradation initiation, and failure. Raman spectroscopy and AFM topography imaging were able to sense the early degradation initiation, while impedance spectroscopy and local dc current mapping did not show signs of degradation. The results can be useful in selecting appropriate investigation techniques for accurate evaluation of polymer degradation onset.
PROGRESS IN ORGANIC COATINGS
(2023)
Article
Chemistry, Physical
Paolo Canepa, Giorgia Ghiara, Roberto Spotorno, Maurizio Canepa, Ornella Cavalleri
Summary: The growth of anodic oxide on niobium was investigated in a solution containing P and Ca-EDTA complexes. It was found that below the breakdown potential, thin and uniform oxide layers were formed, while above the breakdown potential, thicker and microporous oxide layers were observed with enrichment of Ca and P. An anodizing potential of around 200 V was identified as a good tradeoff between morphological and compositional properties and resistance to corrosion.
JOURNAL OF ALLOYS AND COMPOUNDS
(2021)
Article
Construction & Building Technology
Rachid Hsissou, Said Abbout, Zaki Safi, Fouad Benhiba, Nuha Wazzan, Lei Guo, Khalid Nouneh, Samir Briche, Hamid Erramli, Mohamed Ebn Touhami, Mohammed Assouag, Ahmed Elharfi
Summary: A novel EPT epoxy polymer was developed and investigated for its anticorrosive performance on carbon steel in [1 M] HCl medium. Experimental results showed high inhibitory efficiencies of EPT through chemical adsorption to resist acid attack, demonstrating its potential as an inhibitor for carbon steel. Computational approaches further supported these findings, indicating spontaneous adsorption and affirming the effectiveness of EPT.
CONSTRUCTION AND BUILDING MATERIALS
(2021)
Article
Chemistry, Physical
Moussa Ouakki, Mouhsine Galai, Zakaria Benzekri, Zakia Aribou, Elhachmia Ech-chihbi, Lei Guo, Khadija Dahmani, Khalid Nouneh, Samir Briche, Said Boukhris, Mohammed Cherkaoui
Summary: This study investigated the corrosion inhibition of two novel pyran derivatives on mild steel in hydrochloric acid medium. Experimental results showed that the inhibition effectiveness of these compounds increased with concentration and followed the Langmuir adsorption model. Surface characterization analysis supported the presence of a barrier layer on the mild steel surface due to the adsorption of the compounds.
JOURNAL OF MOLECULAR LIQUIDS
(2021)
Article
Materials Science, Multidisciplinary
Sh Shirazeh Mohabbat, A. A. Sarabi, H. Eivaz Mohammadloo
Summary: In this study, the AZ31 Mg alloy was coated with a one-step zirconium-based conversion coating (ZrCC) by adding adipic acid (AA) and manganese (Mn) as additives. The morphology and composition of the samples were analyzed, and the electrochemical behavior of the coatings was evaluated. The Zr-Mn sample showed the highest polarization resistance and the lowest current density, indicating superior corrosion resistance.
MATERIALS TODAY COMMUNICATIONS
(2023)
Article
Chemistry, Physical
P. S. Desai, Falguni Desai, Adarsh Patel, Bhumika Parmar
Summary: This study explores the application of Eucalyptus leaves extract (ELE) as an anticorrosive agent for aluminium alloy in 0.5 M HCl. The results show that ELE has excellent inhibition efficiency at a concentration of 0.5% ELE at 303 K. The adsorption of ELE on the metal surface follows the Langmuir adsorption isotherm models. The corrosion inhibition mechanism involves charge transfer control and ELE acts as a mixed-type inhibitor.
APPLIED SURFACE SCIENCE ADVANCES
(2023)
Article
Materials Science, Multidisciplinary
Arafat Toghan, Ahmed Fawzy, Abbas I. Alakhras, Moustafa M. S. Sanad, M. Khairy, Ahmed A. Farag
Summary: A new ionic liquid called ILB has been used as an effective inhibitor to prevent corrosion of carbon steel in aggressive HCl solution. The ILB shows good performance even at low dosing levels and achieves an inhibition efficiency of about 97%. Practical and theoretical studies have yielded consistent results.
Article
Polymer Science
Rachid Hsissou, Khadija Dahmani, Anouar El Magri, Abdelfettah Hmada, Zaki Safi, Nadia Dkhireche, Mouhsine Galai, Nuha Wazzan, Avni Berisha
Summary: In this study, a tetrafunctional epoxy resin called TGP was tested as a potential corrosion inhibitor for mild steel in 0.5 M H2SO4 solution. Various techniques were employed to investigate the corrosion inhibition process, including PDP, EIS, TE, SEM, EDS, and theoretical approaches. The results showed that at the optimal concentration (10(-3) M), the epoxy resin had corrosion efficacies of 85.5% (EIS) and 88.6% (PDP). The resin acted as an anodic inhibitor, forming a protective layer on the metal surface and preventing sulfur ion attack. DFT calculation and RDF, MC, and MD simulations provided further insights into the inhibitory efficiency of the epoxy resin.
Article
Chemistry, Physical
Z. El-kiri, A. Hmada, R. Sayed, K. Dakhsi, A. Larioui, F. Benhiba, R. Hsissou, N. Dkhireche, M. Galai, M. Ebntouhami
Summary: In this study, a novel epoxy resin PGH was synthesized and its anticorrosive properties for mild steel in 1M HCl solution were investigated. The experiment results and theoretical calculations confirmed that PGH exhibited good inhibitory efficiency against corrosion of mild steel in 1M HCl.
JOURNAL OF MOLECULAR STRUCTURE
(2023)
Article
Chemistry, Inorganic & Nuclear
Hoyam Chahmout, Moussa Ouakki, Sarra Sibous, Mouhsine Galai, N. Arrousse, E. Ech-chihbi, Zakaria Benzekri, Said Boukhris, Abdelaziz Souizi, Mohammed Cherkaoui
Summary: This paper investigates the adsorption of two novel heterocyclic compounds on the stainless steel surface in 2.0 M H2SO4. The inhibitory properties of the compounds increase with concentration. The inhibition efficiencies of Py-1 and Py-2 are 96.7% and 90.9% respectively. The adsorption of the inhibitors follows the Langmuir Isotherm adsorption model.
INORGANIC CHEMISTRY COMMUNICATIONS
(2023)
Article
Chemistry, Physical
Imane Lebkiri, Brahim Abbou, Rachid Hsissou, Zaki Safi, Makfire Sadiku, Avni Berisha, Abdelhay El Amri, Youness Essaadaoui, Lamya Kadiri, Ahmed Lebkiri, El Housseine Rifi
Summary: This study investigates the use of anionic polyacrylamide hydrogels for the removal of cationic dye crystal violet from aqueous solutions. Batch adsorption studies show that the maximum adsorption capacity of the dye is 378 mg/g at an initial concentration of 300 mg/L, pH = 5, T = 298 K, and 0.039 g of the adsorbent. The adsorption mechanism follows the pseudo-second-order model, and the equilibrium adsorption follows the Langmuir model. Thermodynamic analysis suggests that the adsorption process is spontaneous and endothermic. Density functional theory (DFT), molecular dynamic (MD), and Monte-Carlo simulation studies were used to support the experimental findings.
JOURNAL OF MOLECULAR LIQUIDS
(2023)
Article
Chemistry, Multidisciplinary
F. Benhiba, Z. Benzekri, Y. Kerroum, N. Timoudan, R. Hsissou, A. Guenbour, M. Belfaquir, S. Boukhris, A. Bellaouchou, H. Oudda, A. Zarrouk
Summary: The new compound THP was studied for its inhibitive effect on the electrochemical decomposition of carbon steel in an acidic medium. Experimental and computational results showed that THP exhibited mixed inhibition with the highest effectiveness at a concentration of 10-3M. Adsorption on carbon steel followed the Langmuir model, and the adsorption parameters indicated physical adsorption, increasing the barrier energy for corrosion reaction.
JOURNAL OF THE INDIAN CHEMICAL SOCIETY
(2023)
Correction
Biochemistry & Molecular Biology
M. Rbaa, M. Fardioui, Chandrabhan Verma, Ashraf S. Abousalem, M. Galai, E. E. Ebenso, T. Guedira, B. Lakhrissi, I. Warad, A. Zarrouk
INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES
(2023)
Article
Polymer Science
Rachid Hsissou, Khadija Dahmani, Anouar El Magri, Abdelfettah Hmada, Zaki Safi, Nadia Dkhireche, Mouhsine Galai, Nuha Wazzan, Avni Berisha
Summary: In this study, a tetrafunctional epoxy resin called TGP was tested as a potential corrosion inhibitor for mild steel in 0.5 M H2SO4 solution. Various techniques were employed to investigate the corrosion inhibition process, including PDP, EIS, TE, SEM, EDS, and theoretical approaches. The results showed that at the optimal concentration (10(-3) M), the epoxy resin had corrosion efficacies of 85.5% (EIS) and 88.6% (PDP). The resin acted as an anodic inhibitor, forming a protective layer on the metal surface and preventing sulfur ion attack. DFT calculation and RDF, MC, and MD simulations provided further insights into the inhibitory efficiency of the epoxy resin.
Article
Chemistry, Physical
Ayoub Kaaouass, Abdelkader Ben Ali, Hassan Ait Ahsaine, Ghizlaine Kaichouh, Abdelkader Zarrouk, Mohamed Saadi
Summary: The aim of this study is to investigate the photocatalytic properties and chemical durability of the CaO-B2O3-V2O5 glasses system. The prepared borovanadate glasses were confirmed to be amorphous. Replacing V2O5 with B2O3 improved the chemical durability, which could be explained by the increase in glass transition temperature. The photodegradation of methylene blue by the prepared photocatalysts followed pseudo-first-order rate kinetics, and 40 CaO-30 B2O3-30 V2O5 showed the highest removal efficiency of about 99% in 180 min.
Article
Materials Science, Multidisciplinary
Fouad Benhiba, Mohcine Missioui, Selma Lamghafri, Rachid Hsissou, Abdelkbir Bellaouchou, Hassan Oudda, Abdellatif Lamhamdi, Ismail Warad, Youssef Ramli, Abdelkader Zarrouk
Summary: In this study, the anti-corrosion performance of 1-dodecyl-3-phenylquinoxalin-2(1H)-one (QO12) for carbon steel (CS) was evaluated using various techniques. The results showed that QO12 achieved a maximum inhibition performance of 95.33% at a concentration of 0.001 M. The study revealed that QO12 acted as a mixed-type inhibitor and the corrosion process of CS was dominated by a transfer-of-charge mechanism. The adsorption of quinoxalinone followed the Langmuir adsorption isotherm. SEM analysis showed no corrosion deterioration after the addition of QO12.
Article
Electrochemistry
Zakia Aribou, Moussa Ouakki, Nidal Khemmou, Sarra Sibous, Elhachmia Ech-chihbi, Zakaria Benzekri, Mouhsine Galai, Said Boukhris, Abeer A. AlObaid, Ismail Warad, Mohamed Ebn Touhami
Summary: The current study investigates the adsorption properties of a novel heterocyclic compound, DDIP, as an inhibitor against the oxidation of brass in hydrochloric acid solution. Experimental investigation included EIS and PDP methods, revealing an inhibition efficiency of 90.0%. The adsorption process of the inhibitor on the brass substrate followed the Langmuir adsorption model, and SEM/EDS and XRD techniques confirmed the presence of a protective film overlaying the brass substrate. DFT calculations showed the existence of many active sites on the brass surface, facilitating the adsorption of the inhibitor.
JOURNAL OF APPLIED ELECTROCHEMISTRY
(2023)
Article
Chemistry, Physical
S. Alaoui Mrani, E. Ech-Chihbi, R. Salim, S. Daoui, N. Benchat, T. Saffaj, A. Zarrouk, M. Taleb
Summary: The anticorrosive activity of two novel synthesized pyridazine-based compounds, PZ-H and PZ-O-CH3, was studied in 1 M HCl acidic medium using DFT quantum chemistry and Monte Carlo simulation. The experimental results were confirmed by electrochemical methods and UV-visible spectroscopic analysis, and SEM/EDX surface analysis was also used. The compounds exhibited good inhibitory efficiency against corrosion, with a maximum inhibition of 92% for PZ-H and 95% for PZ-O-CH3 at a concentration of 1 x 10(-3) M and 298 K temperature. The compounds showed stable inhibitory efficiency even with increasing temperature and immersion time.
JOURNAL OF MOLECULAR LIQUIDS
(2023)
Article
Chemistry, Physical
Nawaf Al-Maharik, Malak Daqqa, Abeer AlObaid, Abdelkader Zarrouk, Ismail Warad
Summary: In this study, a novel compound, 2,7-dimethoxy-3-(4-methoxyphenyl)-3-methylchroman-4-one, was synthesized in high yield as a racemic mixture using a one-pot procedure. Various analytical techniques, including NMR, CHN-EA, FT-IR, UV-vis, and XRD-crystal examinations, were employed for characterization. The XRD investigation revealed the presence of distinct synthons formed through short interactions involving CMe-HO and Cph-HO. The calculated optical energy from Tauc's relation was compared to theoretical values obtained from HOMO/LUMO and density of state (DOS) calculations.
JOURNAL OF MOLECULAR STRUCTURE
(2023)
Article
Chemistry, Physical
Adil Ech-chebab, Khadija Dahmani, Rachid Hsissou, Outman El Khouja, Dakeshwar Kumar Verma, Elyor Berdimurodov, Saban Erdogan, Burak Tuzun, Redouane Lachhab, Aadil Ejbouh, Mouhsine Galai, Mohamed Ebn Touhami
Summary: The inhibitory performance of epoxy polymer (TGETBAU) on mild steel (M-S) in 1.0 M HCl solution was assessed using potentiodynamic polarization and electrochemical impedance spectroscopy. The effects of TGETBAU molecule on corrosion inhibition and the adsorption of epoxy polymer on M-S surface were investigated using density functional theory calculation and molecular dynamics simulation. The highest inhibitory efficiency of 93% was achieved at 303 K with 2.0 g/L of TGETBAU. The corrosion of M-S was inhibited through Langmuir adsorption mechanism. The theoretical calculations were consistent with the experimental results. Moreover, M-S was protected in 1.0 M HCl, as confirmed by scanning electron microscopy and X-ray diffraction analysis.
JOURNAL OF MOLECULAR STRUCTURE
(2023)
Article
Engineering, Chemical
Assia Jebli, Abdelhay El Amri, Rachid Hsissou, Azzedine Lebkiri, Basma Zarrik, Fatima Zahra Bouhassane, El mahdi Hbaiz, El Housseine Rifi, Ahmed Lebkiri
Summary: Novel chitosan and hydroxyapatite-based bio composites were synthesized and studied as effective adsorbents for the removal of crystal violet. The physical and functional properties of the composite were analyzed using various techniques, confirming its suitability for dye adsorption. The optimization of adsorption parameters resulted in a high adsorption efficiency of 93.21%.
JOURNAL OF THE TAIWAN INSTITUTE OF CHEMICAL ENGINEERS
(2023)
Article
Chemistry, Physical
Abderrahim Titi, Ismail Badran, Mohammed Dahmani, Mouslim Messali, Rachid Touzani, Abdelkader Zarrouk, Yann Garcia, Mousa Al-Noaimi, Mohammed Suleiman, Ismail Warad
Summary: A coordination complex, CoCl2(NNH)2, was synthesized rapidly and efficiently using microwave radiation in water solvent without side products. The formation of the complex was confirmed by various analysis techniques and compared to theoretical calculations. The complex exhibits antibacterial and antifungal activities, and its physio-chemical properties and pharmacophore sites were studied using computational analysis.
JOURNAL OF MOLECULAR STRUCTURE
(2023)
Article
Materials Science, Multidisciplinary
N. Achnine, M. Driouch, A. Elhaloui, Z. Lakbaibi, El H. El Assiri, M. Kadiri, M. Sfaira, O. Dagdag, A. Berisha, B. El Ibrahimi, S. Kaya, L. Guo, A. Zarrouk
Summary: The article highlights common pitfalls in the literature, including deductions based on isolated inhibitors, the limitations of quantum methods in accounting for environmental aggressiveness, distrust in interpreting small energy descriptor differences, and the use of simplistic surface models. The study focuses on local reactivity descriptors for the molecule 6-chloro-2-phenylimidazo[1,2-b]pyridazine, and highlights the importance of considering the corrosive medium's nature and concentration. DM and MC methods are used to account for inhibitor-metal interactions and the dynamic aspects of the adsorption process. The study reveals that the adsorption energy of CP-IPZH does not reflect the polarization resistance in different concentrations of HCl.
INTERNATIONAL JOURNAL OF CORROSION AND SCALE INHIBITION
(2023)
Article
Chemistry, Physical
Khadija Dahmani, Mouhsine Galai, Mohamed Rbaa, Adil Ech-Chebab, Nordine Errahmany, Lei Guo, Abeer A. Alobaid, Abdelfettah Hmada, Ismail Warad, Brahim Lakhrissi, Mohamed Ebn Touhami, Mohammed Cherkaoui
Summary: In this study, the inhibiting effects of two quinoline derivatives on the corrosion of mild steel were investigated using experimental and computational approaches. It was found that these compounds could delay the corrosion of mild steel, decrease the rates of anodic and cathodic corrosion reactions, and form a protective film to prevent the steel from acid ion attack.
JOURNAL OF MOLECULAR STRUCTURE
(2024)
Article
Chemistry, Physical
Rajalaxmi Sahoo, C. Reshma, D. S. Shankar Rao, C. V. Yelamaggad, S. Krishna Prasad
Summary: This study investigates the influence of the flexible spacer parity of a guest photoactive liquid crystalline dimer on the photonic bandgap features of the cholesteric and twist grain boundary smectic C phases of the host molecule. The results show that the parity of the photoactive dimer affects the width of the photonic bandgap and the blue-shift of the cholesteric phase. Additionally, the parity of the dimer also affects the layer spacing and two-dimensional periodicity of the liquid crystalline phases.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Sara Rozas, Alberto Gutierrez, Mert Atilhan, Alfredo Bol, Santiago Aparicio
Summary: This study presents a multiscale theoretical investigation on the use of bifunctional hydrophobic Deep Eutectic Solvent for carbon capture using tetrapropylammonium chloride, acetic acid, and ethanolamine. The characterization includes nanoscale analysis of CO2 absorption mechanisms and changes in liquid phase properties during gas capture.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Tabouli Eric Da-yang, Alhadji Malloum, Jean Jules Fifen, Mama Nsangou, Jeanet Conradie
Summary: In this study, the potential energy of different glycine tautomers and their interaction with Cu2+ cations was investigated. The results showed that the solvation medium and the presence of Cu2+ cations influenced the stability of glycine tautomers.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Xiaoliang Gou, Nan Ye, Qingqing Han, Junjie Cui, Long Yi Jin
Summary: In this study, amphiphilic rod-coil molecules with rigid DSA parts and flexible oligoether chains were designed and their assembly capacities were investigated. The morphology of the molecular aggregates was influenced by the pH of the solution and UV light, and the aggregates showed adsorption capacity for nitroaromatic compounds.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Shuang Liu, Liyan Shan, Cong Qi, Wenhui Zhang, Guannan Li, Bei Wang, Wei Wei
Summary: Optimizing the design of styrene-butadiene-styrene copolymer (SBS) is crucial for producing cost-effective SBS modifiers and improving road quality. This study examined the influence of SBS content and molecular structure on viscosity and compatibility. The results showed that the viscosity contribution of SBS is determined by its molecular structure and phase morphology.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Artem A. Petrov, Ekaterina A. Titova, Aydar A. Akhmadiyarov, Ilnaz T. Rakipov, Boris N. Solomonov
Summary: This work focuses on the thermochemistry of solvation of azeotropes. The enthalpies of dissolution of azeotropes in different mediums were determined, and the impact of the structure of the azeotropes on their properties in solution was discussed. A correlation between enthalpies of solvation and molar refraction was used to determine the vaporization enthalpies of azeotropes for the first time. The results were found to be consistent with literature data, obtained using direct and calculated methods. These findings contribute to the analysis of the structure-property relationships of azeotropes.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
L. V. Kamaeva, E. N. Tsiok, N. M. Chtchelkatchev
Summary: Understanding the correlations between liquids and solids allows us to predict the thermodynamic parameter range favorable for the formation of intriguing solid phases by studying liquids. In this study, we experimentally and theoretically investigated an Al-Cu-Co system within different composition ranges, and identified high-temperature solid phases. Our findings demonstrated the correlation between the boundaries of different solid phases and undercooling and viscosity in the concentration area.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
R. Aneesh Kumar, S. Jamelah Al-Otaibi, Y. Sheena Mary, Y. Shyma Mary, Nivedita Acharjee, Renjith Thomas, Renjith Raveendran Pillai, T. L. Leena
Summary: In this study, the interactions between doped and pristine coronenes and adenine nucleobases were investigated using Density Functional Theory. The optimal configurations, adsorption energies, charge transfer, and electrical properties of each complex were calculated. It was found that doped coronene had stronger adsorption strength and charge transfer compared to pristine coronene. The stability of the complexes was attributed to non-covalent interactions in the interactive region. The change in electrical conductivity of coronenes after adsorption suggested their sensitivity towards DNA bases. The predicted energy gap and prolonged recovery time for adenine-coronene configurations indicated the potential application of pristine/doped coronene in DNA detection.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Gang Zhou, Yongwei Liu, Biao Sun, Zengxin Liu, Cuicui Xu, Rulin Liu, Qi Zhang, Yongmei Wang
Summary: The CFD-DEM method was used to simulate the dust deposition pattern in the bronchus of anchor digging drivers, revealing the highest dust concentration in the vortex region of the working face. The study also found a positive correlation between dust particle diameter and bronchial deposition rate, and a negative correlation with alveolar deposition rate.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Yan Zhang, Yafei Luo, Lingkai Tang, Mingyan E, Jianping Hu
Summary: This study investigates the effects of different transition metal decorations on B12N12 nanocages on the adsorption properties of nitrosourea drugs using computational methods. The results reveal the presence of weak non-covalent interactions between metals and nanocages, and the interaction between drugs and nanocages plays a significant role in drug adsorption. Compared to free drugs, the adsorption of drugs on nanocages can facilitate electron transfer, reduce energy gaps and chemical hardness, indicating activity at the target site.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
C. I. Alcolado, J. Poblete, L. Garcia-Rio, E. Jimenez, F. J. Poblete
Summary: In this study, the selective oxidation of aromatic aldehydes was investigated using Ru(VI) as a catalyst and hexacyanoferrate (III) as a cooxidant in an alkaline medium. The reaction mechanism involves complex reaction orders for the oxidant and the aromatic aldehyde, while the reaction order for Ru(VI) is one. The proposed mechanism includes two catalytic cycles and the formation and decomposition of complexes. Quantitative structure-activity relationship analysis showed that deactivating groups in the para-position enhance the process.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Inez A. Barbieri, Marcos L. S. Oliveira, Franciele S. Bruckmann, Theodoro R. Salles, Leonardo Zancanaro, Luis F. O. Silva, Guilherme L. Dotto, Eder C. Lima, Mu. Naushad, Cristiano R. Bohn Rhoden
Summary: This study evaluated the adsorption of zolpidem on magnetic graphene oxide and synthesized magnetic graphene oxide adsorbents for zolpidem removal. The best magnetic nanoadsorbent was found to have a removal percentage of 87.07% at specific pH and temperature conditions. The results suggest that the removal of zolpidem is related to the surface chemistry of the adsorbent rather than the surface area of graphene oxide. The adsorbent showed excellent adsorption efficiency and magnetic behavior, making it a promising material for removing zolpidem from aqueous solutions.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Hongyan Huang, Chunquan Li, Siyuan Huang, Yuling Shang
Summary: This study examines the sensitivity of the thermal conductivity of water-based alumina nanofluids to changes in concentration, sphericity, and temperature. The results show that volume fraction and temperature have a significant impact on the thermal conductivity, while sphericity also needs to be considered. A support vector machine regression model was created to analyze the sensitivity of the thermal conductivity to different parameters. The findings indicate that temperature, sphericity, and volume fraction are the most sensitive variables.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Correction
Chemistry, Physical
V. M. Pergamenshchik, T. Bryk, A. Trokhymchuk
JOURNAL OF MOLECULAR LIQUIDS
(2024)
Article
Chemistry, Physical
Valentyn Rudenko, Anatolii Tolochko, Svitlana Bugaychuk, Dmytro Zhulai, Gertruda Klimusheva, Galina Yaremchuk, Tatyana Mirnaya, Yuriy Garbovskiy
Summary: This paper reports on the synthesis, structural characterization, spectral and nonlinear-optical properties of glass nanocomposites made of glass forming ionic liquid crystals and nanoparticles. The study reveals that by exciting the nanocomposites within their absorption band, a control over effective optical nonlinearities can be achieved, allowing the modification of the magnitude and sign of the effective nonlinear absorption coefficient. The proposed strategy using metal-alkanoates based glass-forming ionic liquid crystals and nanoparticles shows great potential for the development of nanophotonics and plasmonics technologies.
JOURNAL OF MOLECULAR LIQUIDS
(2024)
