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Full-Text Articles in Chemistry

The Inhibition Activity Of Tert-Butylhydroquinone Towards Corrosion Of Aluminum, Copper And Stainless Steel In Biodiesel Blend B20 Alternative Fuel, Chaza Joumaa, Ibtissam Saad, Ghassan Younes Dec 2021

The Inhibition Activity Of Tert-Butylhydroquinone Towards Corrosion Of Aluminum, Copper And Stainless Steel In Biodiesel Blend B20 Alternative Fuel, Chaza Joumaa, Ibtissam Saad, Ghassan Younes

BAU Journal - Science and Technology

Tert-butylhydroquinone (TBHQ) has been investigated as corrosion inhibitor for aluminum; copper and stainless steel in biodiesel blend B20 by using electrochemical impedance spectroscopy (EIS) method. The results showed that the inhibition efficiency increases with an increase in the concentration of TBHQ but decreases with increasing temperature from 30℃ to 60℃. A maximum inhibition efficiency of about 61.52% for aluminum was recorded for THBQ in biodiesel blend B20 at temperature 30℃ and at a concentration of 4x10-6 M which is the lowest concentration used compared to the concentrations of TBHQ used for the other metals (copper and stainless steel). Theoretical …


Self-Assembly Of Black Cumin Oil-Based Nanoemulsion On Various Surfactants: A Molecular Dynamics Study, Aulia Fikri Hidayat, Taufik Muhammad Fakih Dec 2021

Self-Assembly Of Black Cumin Oil-Based Nanoemulsion On Various Surfactants: A Molecular Dynamics Study, Aulia Fikri Hidayat, Taufik Muhammad Fakih

Makara Journal of Science

Black cumin is commonly used as traditional medicine due to its wide range of pharmacological potential. Black cumin oil (BCO) was often prepared as nanoemulsion to improve its solubility, stability, and bioavailability. This study was conducted to investigate the molecular behavior as well as structural evolution of BCO-surfactant systems during self-assembly micellization using molecular dynamics (MD) simulations. Several BCO constituents and variations of surfactants were employed to model BCO-surfactant systems. 50 ns of MD simulations were performed to elucidate their evolution of structures and physicochemical properties during formation. Results showed that BCO-tween20 and BCO-lecithin were able to form spherical-shaped micelles …


Photoelectrochemical Sensing Based On Zr-Mofs For Homocysteine Detection, Wen-Xia Dong, Guang-Ming Wen, Bin Liu, Zhong-Ping Li Dec 2021

Photoelectrochemical Sensing Based On Zr-Mofs For Homocysteine Detection, Wen-Xia Dong, Guang-Ming Wen, Bin Liu, Zhong-Ping Li

Journal of Electrochemistry

Due to the independent form of the light source and detection system, photoelectrochemical (PEC) sensor has the advantages of low background, high sensitivity and simple operation. So far, PEC systems have been widely used in the fields including the actual detection of metal ions, biological antibodies or antigens in environmental pollutants. When the photosensitive material is irradiated by a light source with an energy being equal to or greater than its band gap, electrons (e-) transition occurs from the valence band to the conduction band, leaving a hole (h+), at the same time, the generated electron-hole pair (e-/h+) separate, and …


Influence Of Heat Treatment Time On Cathode Material Cr8O21 For Lithium Battery, Jiu-Kang Teng, Qing-Jie Wang, Liang Zhang, Hong-Mei Zhang, Xiao-Tao Chen, Peng Zhang, Jin-Bao Zhao Dec 2021

Influence Of Heat Treatment Time On Cathode Material Cr8O21 For Lithium Battery, Jiu-Kang Teng, Qing-Jie Wang, Liang Zhang, Hong-Mei Zhang, Xiao-Tao Chen, Peng Zhang, Jin-Bao Zhao

Journal of Electrochemistry

Chromium oxide (Cr8O21) cathode material for lithium batteries was synthesized by thermal decomposition of chromium trioxide (CrO3) at high temperature. The electrochemical properties of chromium oxide depended on the time and temperature during the heat treatment. Pure phase chromium oxide was prepared, and the effects of heat treatment time on the structures and electrochemical properties of Cr8O21 were systematically studied. The first discharge mechanism of chromium oxide in lithium batteries was explored, and the results were similar to that in lithium-sulfur batteries. The crystal phases and electrochemical properties of the prepared …


Copper Nanoparticles In-Situ Anchored On Nitrogen-Doped Carbon For High-Efficiency Oxygen Reduction Reaction Electrocatalyst, Hui-Fang Yuan, Yue Zhang, Xing-Wu Zhai, Li-Bing Hu, Gui-Xian Ge, Gang Wang, Feng Yu, Bin Dai Dec 2021

Copper Nanoparticles In-Situ Anchored On Nitrogen-Doped Carbon For High-Efficiency Oxygen Reduction Reaction Electrocatalyst, Hui-Fang Yuan, Yue Zhang, Xing-Wu Zhai, Li-Bing Hu, Gui-Xian Ge, Gang Wang, Feng Yu, Bin Dai

Journal of Electrochemistry

Compared with noble metal platinum (Pt)-based catalysts, inexpensive non-noble metal electrocatalysts have attracted extensive attention for oxygen reduction reaction (ORR). Herein, chitosan as a kind of biomass resource rich in nitrogen and carbon was used to prepare nitrogen-doped carbon (N-C) and N-C in-situ anchored by copper nanoparticles (Cu/N-C). The as-obtained N-C and Cu/N-C nanoparticles were successfully used as non-noble eletrocatalysts tested for ORR. Compared with the N-C, the Cu/N-C showed the high surface area of 607.3 m 2·g-1 with the mean pore size of 2.5 nm and the pore volume of 0.40 cm3·g-1. The most positive Gibbs free …


Formation And Morphological Evolution Of Nanoporous Anodized Iron Oxide Films, Jin-Wei Cao, Nan Gao, Zhao-Qing Gao, Chen Wang, Sheng-Yan Shang, Yun-Peng Wang, Hai-Tao Ma Dec 2021

Formation And Morphological Evolution Of Nanoporous Anodized Iron Oxide Films, Jin-Wei Cao, Nan Gao, Zhao-Qing Gao, Chen Wang, Sheng-Yan Shang, Yun-Peng Wang, Hai-Tao Ma

Journal of Electrochemistry

The preparation of iron oxide films with nanoporous structure by anodization has attracted much attention for its potential applications. However, the formation mechanism of porous structure during anodization is still unclear. In this paper, the composition of anodic current during the formation of nanoporous anodized iron oxide film was analyzed in combination with the current density-potential response (I-V curve) and the derivation of Faraday’s law. The results showed that the anodic current consisted of an ionic current (leading to the migration of ions to form oxide) and an electronic current (leading to the oxygen evolution), and the …


Cyclic Voltammetric Simulations On Batteries With Porous Electrodes, Xue-Fan Cai, Sheng Sun Dec 2021

Cyclic Voltammetric Simulations On Batteries With Porous Electrodes, Xue-Fan Cai, Sheng Sun

Journal of Electrochemistry

Lithium-ion batteries (LIBs) are among the most widely used energy storage devices. Whole-cell modeling and simulations of LIBs can optimize the design of batteries with lower costs and higher speeds. The Pseudo-Two-Dimensional (P2D) electrochemical model is among the most famous whole-cell models and widely applied in LIB simulations. P2D model consists of a series of kinetic equations to model Li+/Li diffusion in working/counter electrodes and electrolytes, which are filled in the porous electrodes and separator, and reactions at the interface of electrolyte and active particles. The traditional applications of P2D model, however, are limited to the cases where the current …


Effect Of Aluminum Alloy Surface Modification On Adhesion Of The Modified Polyurethane Coating And Its Corrosion Protective Performance, Xian-Yin Kuang, Shao-Qiang Jin, Yan-Hui Cao, Yan-Mei Zhang, Shi-Gang Dong, Long-Hui Zhu, Li-Wen Lin, Chang-Jian Lin Dec 2021

Effect Of Aluminum Alloy Surface Modification On Adhesion Of The Modified Polyurethane Coating And Its Corrosion Protective Performance, Xian-Yin Kuang, Shao-Qiang Jin, Yan-Hui Cao, Yan-Mei Zhang, Shi-Gang Dong, Long-Hui Zhu, Li-Wen Lin, Chang-Jian Lin

Journal of Electrochemistry

The ordinary organic coatings on aluminum alloy usually encounter a problem of low adhesion to the substrate, which results in destruction and failure of the long-term protective performance of the anticorrosion systems. The surface modification of aluminum alloy is able to enhance the adhesion of organic coating on aluminum alloys, and to improve their protective performance. In this work, a combined surface modification of anodic oxidation and mussel adhesion protein/CeO2/3-aminopropyltriethoxysilane composite film (MCA) was developed on the aluminum alloy. The adhesion of modified polyurethane coated on the treated aluminum alloy and its corrosion protective performance were evaluated comprehensively …


Functional Sulfate Electrolytes Enable The Enhanced Cycling Stability Of Nati2(Po4)3/C Anode Material For Aqueous Sodium-Ion Batteries, Shu-Jin Li, Zhi-Kang Cao, Wen-Kai Wang, Xiao-Han Zhang, Xing-De Xiang Dec 2021

Functional Sulfate Electrolytes Enable The Enhanced Cycling Stability Of Nati2(Po4)3/C Anode Material For Aqueous Sodium-Ion Batteries, Shu-Jin Li, Zhi-Kang Cao, Wen-Kai Wang, Xiao-Han Zhang, Xing-De Xiang

Journal of Electrochemistry

Aqueous sodium-ion batteries show promising application in fields of large-scale storage of intermittent renewable energies owing to the earth-abundant sodium resources and incombustible aqueous electrolytes. Primary factors determining whether they can be commercially utilized are low cost and long lifetime. Among current electrode materials, NASICON-type NaTi2(PO4)3 arouses wide interests as an anode material for aqueous sodium-ion batteries as it offers a high specific capacity, fast Na-transport ability and reasonable working potential, however, suffering from insufficient cycling performance caused by severe dissolution of active materials in traditional aqueous electrolytes. In this work, a functional sulfate electrolyte …


Study On The Uniformity Of Microgrooves In Through-Mask Electrochemical Micromachining With Moving Cathode, Li-Qun Du, Yi-Kui Wen, Fa-Long Guan, Ke Zhai, Zuo-Yan Ye, Chao Wang Dec 2021

Study On The Uniformity Of Microgrooves In Through-Mask Electrochemical Micromachining With Moving Cathode, Li-Qun Du, Yi-Kui Wen, Fa-Long Guan, Ke Zhai, Zuo-Yan Ye, Chao Wang

Journal of Electrochemistry

As a typical surface texture, microgrooves have broad prospects in the fields of mechanical engineering, bio-medicine, new energy and efficient heat dissipation of electronic products. Through-mask electrochemical micromachining (TMEMM) is widely used in the fabrication of micro-structures because of high processing efficiency and no residual stress. However, due to the edge effect of current distribution, there is often a serious dimension discrepancy problem in electrochemical machining of micro-structures. In order to weaken the influence of edge effect on the uniformity of microgrooves, the method that TMEMM with a moving cathode is presented. The current distribution in the electrochemical machining is …


Structure Analysis Of Pemfc Cathode Catalyst Layer, Rui-Qing Wang, Sheng Sui Dec 2021

Structure Analysis Of Pemfc Cathode Catalyst Layer, Rui-Qing Wang, Sheng Sui

Journal of Electrochemistry

The sluggish oxygen reduction reaction (ORR) on the cathode of the proton exchange membrane fuel cell (PEMFC) has always been one of the key factors limiting its commercialization. The optimization of the cathode catalytic layer structure plays an important role in improving fuel cell performance and reducing production costs. In this paper, two different catalysts (platinum nanoparticles (Pt-NPs) and platinum nanowires (Pt-NWs)) were prepared by using catalyst coated substrate (CCS) method. By constructing a double-layer catalytic layer structure, we analyzed the effect of different catalytic layer structures by performing a single cell test. The results showed that the dense platinum …


Effect Of Glycol Based Coolant Pollution On Pem Fuel Cells Stack And Recovery Measures, Cong-Yi Zhu, Xiao-Hui Li, Quan-Quan Gan Dec 2021

Effect Of Glycol Based Coolant Pollution On Pem Fuel Cells Stack And Recovery Measures, Cong-Yi Zhu, Xiao-Hui Li, Quan-Quan Gan

Journal of Electrochemistry

As the heat conduction medium of fuel cell cooling system, coolant is very important for the thermal management of fuel cell stack. In practical application, coolant leakage into the stack often occurs. Due to the randomness of fault location of components, the location of coolant leakage is uncertain, which may occur on the cathode side or anode side of some or all single cells. The main effects of coolant pollution on fuel cell stack are as follows: the output of open circuit voltage decreases sharply, the consistency of single cells voltage decreases and so on, which seriously affects the normal …


Nitrogen-Sulfur Co-Doped Porous Carbon Preparation And Its Application In Lithium-Sulfur Batteries, Zhao Gui-Xiang, Hafiz Zaki Ahmed Wail, Zhu Fu-Liang Dec 2021

Nitrogen-Sulfur Co-Doped Porous Carbon Preparation And Its Application In Lithium-Sulfur Batteries, Zhao Gui-Xiang, Hafiz Zaki Ahmed Wail, Zhu Fu-Liang

Journal of Electrochemistry

In recent years, lithium-sulfur (Li-S) batteries have been considered as a promising candidate for the next generation of energy storage system due to their ultrahigh theoretical capacity (1675 mAh·g-1) and energy density (2600 Wh·kg-1). However, the practical application of Li-S batteries is seriously limited by their insulating nature of sulfur, the shuttle effect of polysulfides (LiPSs), and volume expansion during charging and discharging. To overcome those disadvantages, one of the commonly methods is to infiltrate sulfur into porous conductive carbon framework, such as porous carbon, hollow carbon spheres, graphene, carbon nanotubes and some composites of the above structures to achieve …


Application Of Ti/Ruo2-Iro2-Sno2-Sb2O5 Anode In Rural Drinking Water Disinfection, Jing-Ru Guo, Xue-Jiao Zhang, Shuai Liao, Xue-Ming Chen Oct 2021

Application Of Ti/Ruo2-Iro2-Sno2-Sb2O5 Anode In Rural Drinking Water Disinfection, Jing-Ru Guo, Xue-Jiao Zhang, Shuai Liao, Xue-Ming Chen

Journal of Electrochemistry

Sodium hypochlorite disinfection has many advantages, including reliable operation, low cost, easily available raw materials. It is, therefore, suitable for disinfection of drinking water in remote rural areas. The service life and chlorine evolution efficiency of the anode are the main factors restricting the performance of the sodium hypochlorite generator. The special conditions of frequent shutdown and low electrolyte concentration in the rural drinking water application also put forward high requirements on the performance of the anode. In this study, Ti/RuO2-IrO2-SnO2-Sb2O5,a new-type and efficient chlorine evolution anode, was prepared by …


Electrochemical Synthesis Of P-(Β-Hydroxyethyl Sulfone) Aniline, Hao Guo, Dong-Fang Niu, Shuo-Zhen Hu, Xin-Sheng Zhang Oct 2021

Electrochemical Synthesis Of P-(Β-Hydroxyethyl Sulfone) Aniline, Hao Guo, Dong-Fang Niu, Shuo-Zhen Hu, Xin-Sheng Zhang

Journal of Electrochemistry

Para-ester is the most important intermediate for the preparation of ethylene sulfone type reactive dyes, which is usually used in the dyeing of cellulose fibers and synthetic fibers. P-(β-hydroxyethyl sulfone) aniline is an important intermediate for the synthesis of para-ester. In this paper, p-(β-hydroxyethyl sulfone) aniline was prepared by electrochemical method, having the advantages of simple process, mild reaction condition, less environmental pollution, easy reaction control and so on. It has strong development potential and industrial application prospect. The electrochemical reduction of p-nitrophenyl-β-hydroxyethyl sulfone on a lead plate electrode to prepare p-(β-hydroxyethyl …


Performance And Mechanism Of PtXCuY/C Electrocatalyst For Methanol Oxidation, Jia Tang, Xiao-Ming Zhang, Shan-Sheng Yu, Su-Li Wang, Gong-Quan Sun Oct 2021

Performance And Mechanism Of PtXCuY/C Electrocatalyst For Methanol Oxidation, Jia Tang, Xiao-Ming Zhang, Shan-Sheng Yu, Su-Li Wang, Gong-Quan Sun

Journal of Electrochemistry

Direct methanol fuel cell (DMFC), which directly converts the chemical energy of methanol fuel into electrical energy, has the advantages of high energy conversion efficiency, environmental friendliness, and abundance of fuel sources. DMFC is considered as the promising substitutes in the field of portable devices, military applications, and stationary power stations, while the broad application is severely hindered by the sluggish kinetic of methanol oxidation reaction (MOR) in the anode and the high cost of platinum (Pt)-based anodic electrocatalysts. Herein, a series of carbon supported PtxCuy (PtxCuy/C) binary metal electrocatalysts, featured with high …


Fundamentals Of Electrochemical Impedance Spectroscopy For Macrohomogeneous Porous Electrodes, Xiang Li, Qiu-An Huang, Wei-Heng Li, Yu-Xuan Bai, Jia Wang, Yang Liu, Yu-Feng Zhao, Juan Wang, Jiu-Jun Zhang Oct 2021

Fundamentals Of Electrochemical Impedance Spectroscopy For Macrohomogeneous Porous Electrodes, Xiang Li, Qiu-An Huang, Wei-Heng Li, Yu-Xuan Bai, Jia Wang, Yang Liu, Yu-Feng Zhao, Juan Wang, Jiu-Jun Zhang

Journal of Electrochemistry

Electrochemical impedance spectroscopy (EIS) can be used to diagnose charge transfer reactions and mass transport in porous electrodes. The charge transfer reactions include interfacial charge accumulation and charge conduction as well as electrochemical reaction. In this paper, the complex phasor method is developed under the macrohomogeneous assumption to build an impedance model of porous electrodes for clarifying several vague expressions in the traditional approaches. The following researches are carried out: (1) Identifying characteristic parameters for the porous electrodes, including electrode electronic conductivity σ1, electrolyte ionic conductivity σ2, interface charge transfer conductivity gct, unit area …


Effect Of Alkyl Chain Length Of Symmetrical Quaternary Ammonium Hydroxide On Oxalic Acid Electroreduction Reaction, Bo Huang, Xin-Sheng Zhang, Dong-Fang Niu, Shuo-Zhen Hu Oct 2021

Effect Of Alkyl Chain Length Of Symmetrical Quaternary Ammonium Hydroxide On Oxalic Acid Electroreduction Reaction, Bo Huang, Xin-Sheng Zhang, Dong-Fang Niu, Shuo-Zhen Hu

Journal of Electrochemistry

Glyoxylic acid with the dual characteristics of acid and aldehyde is an important chemical raw material and organic synthesis intermediate, which is extensively used in the perfumery, pharmaceutical and fine chemical industries. A family of symmetric quaternary ammonium hydroxides (QAHs) with different alkyl chain lengths was used as the additives in generating glyoxylic acid from oxalic acid electroreduction reaction (OAER). The effects of alkyl chain length on OAER and the corresponding side reaction, i.e., hydrogen evolution reaction (HER), were investigated. Linear sweep voltammetric (LSV) results showed that the adsorption of the additives suppressed more on the HER than that on …


Preparation Of Modified Titanium Based Pbo2 Electrode And Its Rapid Detection Of Cod, Qi Sun, Yan-He Han, Xiao-Lu Fu Oct 2021

Preparation Of Modified Titanium Based Pbo2 Electrode And Its Rapid Detection Of Cod, Qi Sun, Yan-He Han, Xiao-Lu Fu

Journal of Electrochemistry

In the traditional Ti/β-PbO2 electrode, the crystal lattice difference between β-PbO2 and Ti matrix is large, and the prepared electrode is easy to fall off and has a short service life. It needs to be modified in actual use. Based on the advantages of α-PbO2 material and Ag material in terms of adhesion and conductivity, respectively, the above two materials are selected as the intermediate layer of Ti/β-PbO2 electrode to improve electrode performance. In this paper, by preparing Ti/α/β-PbO2 and Ti/Ag/β-PbO2 electrodes …


Janus-Tinbco2 For Hydrogen Evolution Reaction With High Conductivity And Catalytic Activity, Li-Li Xu, Dong-Yan Ren, Xiao-Feng Zhao, Yong Yi Oct 2021

Janus-Tinbco2 For Hydrogen Evolution Reaction With High Conductivity And Catalytic Activity, Li-Li Xu, Dong-Yan Ren, Xiao-Feng Zhao, Yong Yi

Journal of Electrochemistry

Exploring the potential hydrogen evolution reaction (HER) catalysts with the high activity and high conductivity has always been a hot spot in the research of renewable energy development. Ti2C, as one of the 2D-MXene, has excellent properties relating to many active sites, mechanical stability, conductivity, etc., and has become a potential HER catalyst. However, the modification of the surface of Ti2C by terminal O will reduce the conductivity, thereby limiting the transport of electrons between the valence band and the conduction band. In this study, an electric double layer Janus-TiNbCO2 was constructed by Nb doping. …


Numerical Study On The Influences Of Flow Channel And Rib Width Ratio On The Performance Of Gas Diffusion Layer, Rong-Qiang Wei, Shi-An Li, Yi-Hui Liu, Zhi Yang, Qiu-Wan Shen, Guo-Gang Yang Oct 2021

Numerical Study On The Influences Of Flow Channel And Rib Width Ratio On The Performance Of Gas Diffusion Layer, Rong-Qiang Wei, Shi-An Li, Yi-Hui Liu, Zhi Yang, Qiu-Wan Shen, Guo-Gang Yang

Journal of Electrochemistry

Proton exchange membrane fuel cell (PEMFC) has the advantages of low noise, high power density, and zero emission. It is widely used in ships, automobiles, aviation and other fields. PEMFC is composed of bipolar plate (BP), gas diffusion layer (GDL), catalytic layer (CL) and proton exchange membrane (PEM). GDL has a supporting catalytic layer and proton exchange membrane, which provides gas diffusion for the reaction and a channel for the reaction to produce water, and transmits the anodic oxidation reaction. In the assembly of fuel cells, a certain assembly pressure is required to ensure air-tightness and effective conductivity. The assembly …


Study On Improving The Production Of Ammonium Persulfate By Ion Membrane Electrolysis, Yi-Hang Qu, Min Cui, Cong Zhang, Chong Li, Peng Li, Ju-Jie Ren Oct 2021

Study On Improving The Production Of Ammonium Persulfate By Ion Membrane Electrolysis, Yi-Hang Qu, Min Cui, Cong Zhang, Chong Li, Peng Li, Ju-Jie Ren

Journal of Electrochemistry

In china, the production of ammonium persulfate in factories mostly adopts the electrolysis method with simple process and high purity. However, there exists the problem of high energy consumption in the electrolysis process, which restricts the further development of ammonium persulfate in many fields. Aiming at this phenomenon, the equipment and technology to produce ammonium persulfate using electrolysis were designed and studied in order to reduce energy consumption. A new type of zero-pole distance and ion-exchange membrane industrial electrolytic cell was provided for the electrolysis production of ammonium persulfate. An ion-exchange membrane was used to separate the electrolytic cell into …


Synthesis Of Nickel Phosphide/Nitrogen Phosphorus Co-Doped Carbon And Its Application In Lithium Ion Batteries, Jian Hu, Yan-Shuang Meng, Qian-Ru Hu Oct 2021

Synthesis Of Nickel Phosphide/Nitrogen Phosphorus Co-Doped Carbon And Its Application In Lithium Ion Batteries, Jian Hu, Yan-Shuang Meng, Qian-Ru Hu

Journal of Electrochemistry

In recent years, the nickel-based phosphide has drawn great attention because of its low intercalation/deintercalation platform and lower polarization compared to sulfides and oxides as anodes for next-generation high-energy lithium-ion batteries. The Ni2P anode can deliver high theoretical specific capacity of 542 mAh·g-1, but it subject to a conversion reaction mechanism, which make them unsuitable for commercial applications. The agglomeration of Ni2P nanoparticles during material fabrication and the structural deterioration of electrode associated with large volume change during charge-discharge process lead to poor cycle stability and low utilization of active materials. Meanwhile, the low intrinsic conductivity …


Mathematical Expression And Quantitative Analysis Of Impedance Spectrum On The Interface Of Glassy Carbon Electrode, Lei Cheng, Pu-Xuan Yan, You-Jun Fan, Hua-Hong Zou, Hong Liang Oct 2021

Mathematical Expression And Quantitative Analysis Of Impedance Spectrum On The Interface Of Glassy Carbon Electrode, Lei Cheng, Pu-Xuan Yan, You-Jun Fan, Hua-Hong Zou, Hong Liang

Journal of Electrochemistry

Glassy carbon electrode (GCE) is a common basic electrode for various electrochemical sensors, and the detection properties are determined by its interfacial characteristics. In this paper, we established an equivalent circuit including electrolyte resistance (Rel), charge transport resistance (Rct), diffusion impedance (Rdi, Cdi), electrochemical (oxidation/reduction) reaction impedance (RR, CR), surface adsorption impedance (Rads , Cads), double-layer capacitance (CDL), and derived the mathematical expression for the equivalent circuit. The Rel and CDL are contributed by inactive …


National Chemistry Week: From Irl To The Web, Ilayda Kelley, Daniela Mesa Sanchez Oct 2021

National Chemistry Week: From Irl To The Web, Ilayda Kelley, Daniela Mesa Sanchez

Purdue Journal of Service-Learning and International Engagement

National Chemistry Week, an outreach program initiated by the American Chemical Society (ACS), encourages scientists to bring their love of chemistry to their community. Celebrated nationwide, ACS invites businesses, schools, and individuals to organize and participate in community events to promote the value of chemistry in everyday life. The Purdue graduate student chapter of Iota Sigma Pi, a national honor society for women in chemistry, annually organizes one such celebration. On a normal year, this event is a large logistical undertaking in which 100+ volunteers go directly to over 70 local elementary school classrooms and perform a series of activities …


Modeling Vitexin And Isovitexin Flavones As Corrosion Inhibitors For Aluminium Metal, Abdullahi Muhammad Ayuba, Umaru Umar Aug 2021

Modeling Vitexin And Isovitexin Flavones As Corrosion Inhibitors For Aluminium Metal, Abdullahi Muhammad Ayuba, Umaru Umar

Karbala International Journal of Modern Science

Theoretically, the aluminium corrosion inhibitive performance of vitexin (VTX) and isovitexin (SVT) were evaluated with a view of establishing the mechanism of the inhibition process. Calculations which include the consideration of several global descriptors were studied to describe and correlate the reactivity of the molecules with the computed descriptors. First and second-order condensed Fukui functions were employed to analyze local reactivity parameters, while simulations involving the adsorbed molecules on Al (1 1 0) surface were conducted through quench dynamic simulations and the mechanism of physical adsorption was established with SVT relatively been a better inhibitor on Al surface than VTX.


Dft Study Of NiM@Pt1AuN-M-1 (N=19, 38, 55, 79; M = 1, 6, 13, 19) Core-Shell Orr Catalyst, Wen-Jie Li, Dong-Xu Tian, Hong Du, Xi-Qiang Yan Aug 2021

Dft Study Of NiM@Pt1AuN-M-1 (N=19, 38, 55, 79; M = 1, 6, 13, 19) Core-Shell Orr Catalyst, Wen-Jie Li, Dong-Xu Tian, Hong Du, Xi-Qiang Yan

Journal of Electrochemistry

The slow kinetics of oxygen reduction reaction (ORR) limits the performance of low temperature fuel cells. Thus, it needs to design effective catalysts with low cost. Core-shell clusters (CSNCs) show promising activity because of their size-dependent geometric and electronic effects. The ORR activity trend of Nim@Pt1Aun-m-1(n = 19, 38, 55, 79; m = 1, 6, 13, 19) was studied using the GGA-PBE-PAW methods. The adsorption configurations of *O, *OH and *OOH were optimized and the reaction free energies of four proton electron (H+ + e-) transfer steps were calculated. Using …


One-Pot Synthesis Of Fe2O3@Fe-N-C Oxygen Reduction Electrocatalyst And Its Performance For Zinc-Air Battery, Hua Lin, Yi-Jin Wu, Jun-Tao Li, Yao Zhou Aug 2021

One-Pot Synthesis Of Fe2O3@Fe-N-C Oxygen Reduction Electrocatalyst And Its Performance For Zinc-Air Battery, Hua Lin, Yi-Jin Wu, Jun-Tao Li, Yao Zhou

Journal of Electrochemistry

Oxygen reduction reaction (ORR) plays a profound role in determining cathode performance in metal-air batteries and fuel cells. Owing to its inherently sluggish kinetics, high-performance ORR catalysts which favors the scissoring of O-O bond and formation of O-H bond are a requisite. In this regard, Pt has been explored as the most efficient ORR electrocatalysts. Nevertheless, due to its expensiveness, the usage of Pt catalysts represents one of the major sources of cost in those energy conversion devices. Thus, the development of alternative ORR electrocatalysts with minimized Pt utilization has been widely pursued over the past few decades. Metal-nitrogen-carbon catalysts …


A Comparison In Structural Transformation Of Li[NiXCoYMnZ]O2 (X = 0.6, 0.85) Cathode Materials In Lithium-Ion Batteries, Li-Juan Li, Zhen-Dong Zhu, Juan Dai, Rong-Rong Wang, Wen Peng Aug 2021

A Comparison In Structural Transformation Of Li[NiXCoYMnZ]O2 (X = 0.6, 0.85) Cathode Materials In Lithium-Ion Batteries, Li-Juan Li, Zhen-Dong Zhu, Juan Dai, Rong-Rong Wang, Wen Peng

Journal of Electrochemistry

In this paper, the phase transformation voltage ranges of two layered oxide ternary cathode materials, namely, Li(Ni0.85Co0.10Mn0.05)O2 (referred to Ni85, presenting high Ni content) and Li(Ni0.6Co0.2Mn0.2)O2 (referred to Ni60, presenting common low Ni content), were classified and determined. The structural differences between high Ni and common low Ni ternary materials were studied in order to understand the structure instability of high nickel material during the charging process. At the same time, the differential capacity (dQ·dV-1) curves of Ni85 and Ni60 positive electrodes …


A Preliminary Study On Graphene Film-Metal Composites Prepared By Electrodeposition, Shuang-Juan Liu, Hai-Jing Wang, Jing Guo, Peng-Cheng Wang, Hao Zhou, Cai Meng, Han-Jie Guo Aug 2021

A Preliminary Study On Graphene Film-Metal Composites Prepared By Electrodeposition, Shuang-Juan Liu, Hai-Jing Wang, Jing Guo, Peng-Cheng Wang, Hao Zhou, Cai Meng, Han-Jie Guo

Journal of Electrochemistry

Graphene film (GF) has excellent electrical and thermal conductivity, but low strength and hardness. In order to obtain good comprehensive mechanical properties to improve the practical value of GF, the concept of preparing GF-metal composite materials was proposed. This work was conducted to preliminarily study the feasibility of using electrodeposition method to prepare GF-metal composites. Two kinds of composites, GF-Cu and GF-Cr, were successfully prepared by using GF as the cathode, and pure Cu and DSA (Dimensionally Stable Anode) as the anodes, respectively, with applying DC power externally. Employing certain electrochemical parameters, the cation in the electrolyte moved towards the …