Catalysis and Reaction Engineering Commons^™

Microkinetic Modeling And Analysis Of Ethanol Partial Oxidation And Reforming Reaction Pathways On Platinum At Short Contact Times, Maura A. Koehle

Master's Theses

No abstract provided.

Adiabatic Flame Temperature For Combustion Of Methane Ii, Rebeca Pupo

Undergraduate Journal of Mathematical Modeling: One + Two

We calculate the adiabatic flame temperature of a mixture of methane and oxygen in the presence of a diluent gas then determine the mole fractions of methane without respect to nitrogen and solve for the moles of oxygen present. Knowing the moles of methane and oxygen, allows us to calculate the moles of nitrogen present at four constant mole fractions of nitrogen, and the adiabatic flame temperature is determined from the energy released by the reaction. Lastly, we produce several graphs to compare the adiabatic flame temperatures at different mole fractions of nitrogen.

Partial Oxidation Of Ethane To Acetic Acid On Titania Supported Movnbpd Catalyst, Yousef S. Al-Zeghayer, Abdulrhman S. Al-Awadi, Baba Y. Jibril, Moustafa A. Soliman, Sulaiman Al-Mayman

Chemical Engineering

Partial oxidation of ethane was studied on unsupported and supported Mo-V-Nb oxides. Different grades of titania (Crystal-AF4.60, AF7.70 and AF12.5 and Degussa P25) were explored as supports. Samples of the catalyst were characterized using XRD, SEM and BET surface area. The reaction was carried out at 200-275°C and 200 psi. At ethane conversion (6%), unsupported samples exhibited selectivities to ethylene and acetic acid of 76 and 23%, while for Degussa P25-supported sample, the values were 54 and 35%, respectively. Addition of Pd (0.196%) led to an increase in selectivity to acetic acid of 75%.

Self-Assembling Of Gold Nanoparticles Array For Electro-Sensing Applications, Islam M. Al-Akraa Dr, Ahmad M. Mohammad Prof, Mohamed S. El-Deab Prof, Bahgat E. El-Anadouli Prof

Chemical Engineering

A colloidal solution of citrate-stabilized gold nanoparticles (AuNPs) with an average size of ca. 2.6 nm has been prepared, characterized and further implemented in electro-sensing applications. This colloidal solution of AuNPs has been prepared via the reduction of NaAuCl4 with sodium tetrahydroborate (NaBH4) using trisodium citrate as a stabilizer. The optical properties of this solution have been studied with UV–Vis spectroscopy. Next, these AuNPs have been immobilized onto a polycrystalline Au (poly-Au) electrode with the assistance of benzenedimethanethiol (BDMT), which served as a binder. Attention has been taken to ensure the formation of a compact impermeable layer of BDMT on …

The Effects Of Ceria Addition On Aging And Sulfation Of Lean Nox Traps For Stand Alone And Lnt-Scr Applications, Vencon G. Easterling

Theses and Dissertations--Chemical and Materials Engineering

THE EFFECTS OF CERIA ADDITION ON AGING AND SULFATION OF LEAN NO_x TRAPS FOR STAND ALONE AND LNT-SCR APPLICATIONS

Model powder and fully formulated monolithic lean NO_x trap (LNT) catalysts were used to investigate the effect of ceria on desulfation behavior. Temperature-programmed reduction (TPR) experiments (model catalysts) showed each of the oxide phases present is able to store sulfur and possesses distinct behavior (temperature at which desulfation occurs). La-CeO₂ or CeO₂-ZrO₂-containing samples (monoliths) showed a greater resistance to deactivation during sulfation and required lower temperatures to restore the NO_x storage efficiency to …

Electrocatalytic Oxidation Of Formic Acid On Pd/Ni Heterostructured Catalyst, Mingjun Ren, Liangliang Zou, Ju Chen, Ting Yuan, Qinghong Huang, Haifeng Zhang, Hui Yang, Songlin Feng

Journal of Electrochemistry

A Pd/Ni bimetallic nanostructured electrocatalyst was fabricated via a two-step reduction route. Owing to an epitaxial growth of Pd atoms on the surface of Ni nanoparticles, heterostructured Pd/Ni nanocomposites were formed and verified by high resolution transmission electron microscopy combined with energy-dispersion X-ray spectroscopy. X-ray diffraction confirmed that the as-prepared Pd/Ni nanocomposites possessed a single face-centered-cubic (fcc) Pd structure, probably due to a weaker diffraction intensity of metallic Ni and/or overlapping by that of Pd. The intrinsic catalytic activity on the Pd/Ni is higher than that on the Pd. Moreover, the durability of formic acid oxidation on the Pd/Ni was …

Advances And Challenges Of Intermediate Temperature Solid Oxide Fuel Cells: A Concise Review, Sanping Jiang

Journal of Electrochemistry

Fuel cell is an electrochemical energy conversion device to directly convert the chemical energy of fuels to electricity. Among all types of fuel cells, solid oxide fuel cells (SOFCs) operating at intermediate temperatures of 600~800 ^oC offer an attractive option that is much more fuel flexible than low temperature fuel cells such as proton exchange membrane fuel cells, and is suitable for a wide range of applications. However, two main challenges remain towards the commercial viability and acceptance of the SOFC technologies: the cost and durability. Both are critically dependent on the process, fabrication, performance, chemical and microstructural stability …

Electrocatalytic Activity Of Palladium Nanocatalysts Supported On Carbon Nanoparticles In Formic Acid Oxidation, Jie Huang, Zhiyou Zhou, Yang Song, Xiongwu Kang, Ke Liu, Wancheng Zhou, Shaowei Chen

Journal of Electrochemistry

Palladium nanostructures were deposited onto carbon nanoparticle surface by a chemical reduction method. Transmission electron microscopic studies showed that whereas the resulting metal-carbon (Pd-CNP) nanocomposites exhibited a diameter of 20 to 30 nm, the metal components actually showed a cauliflower-like surface morphology that consisted of numerous smaller Pd nanoparticles (3 to 8 nm). Electrochemical studies showed that the effective surface area of the Pd-CNP nanoparticles was about 40% less than that of Pd black, possibly because the Pd nanoparticles were coated with a layer of carbon nanoparticles; yet, the Pd-CNP nanocomposites exhibited marked enhancement of the electrocatalytic activity in formic …

Adsorption And Electrooxidation Of Carbon Monoxide On Platinum Surfaces Modified With Sulfur, A. Mattox Mathew, W. Henney Matthew, Johnson Adam, Zou Shouzhong

Journal of Electrochemistry

Adsorbed sulfur is commonly considered as a reaction poison. However, small amounts of sulfur on platinum significantly increase the surface reactivity toward carbon monoxide (CO) electrooxidation. For the solution CO oxidation, the onset potential was shifted up to over 300 mV negative to that on S-free surface, and the extent of the negative potential shift increases with the sulfur coverage (X_s) up to about 0.6. The enhanced CO oxidation also depends on the solution pH. For the adsorbed CO, at low sulfur coverages (X_s < 0.3), the oxidation peak potential is about 40 mV negative to that of the corresponding clean Pt. However, at higher coverages, the peak potential is about 30 mV more positive. Surface-enhanced Raman spectra show that the adsorption of sulfur significantly redshifts the Pt-CO stretching frequency. These observations are explained by the weakening of the Pt-CO bond and the hindrance of CO diffusion by Sads.

Kinetic Study Of Photoelectrochemical Oxidation Of Lignin Model Compounds On Tio2 Nanotubes, Min Tian, Daniel Liba, Aicheng Chen

Journal of Electrochemistry

In this study, TiO₂ nanotubes were prepared via the electrochemical oxidation of titanium substrates in a non-aqueous electrolyte and their morphology and microstructures were examined by scanning electron microscopy (SEM) and X-ray diffraction (XRD). The photoelectrochemical oxidation of two lignin model compounds, 1-(3,4-dimethoxyphenoxy)-2-(2-methoxyphenoxy)-1,3-propanediol (DMP) and 3-hydroxy-1-(3,4-dimethoxyphenoxy)-2-(2-methoxyphenoxy)-1,3-propanone (HDM), was investigated. A new band appeared at ~304 nm during the photoelectrochemical oxidation of DMP. The rate of DMP intermediate formation was amplified with the increase of initial concentrations, while it was diminished with increased temperature. Despite the similarity in structure between HDM and DMP, there are only small increases in absorbance …

Ternary Alloy Electrocatalysts For Oxygen Reduction Reaction, Jin Luo, Lefu Yang, Binghui Chen, Chuanjian Zhong

Journal of Electrochemistry

Proton exchange membrane fuel cell represents an important electrochemical energy conversion device with many attractive features in terms of efficiency of energy conversion and minimization of environmental pollution. However, the large overpotential for oxygen reduction reaction at the cathode and the low activity, poor durability and high cost of platinum-based catalysts in the fuel cells constitute a focal point of major barriers to the commercialization of fuel cells. The development of nanostructured catalysts shows promises to addresses some of the challenging problems. The ability to engineer the composition and nanostructure of nanoalloy catalysts is important for developing active, robust and …

Refractive Index Chemical Sensing With Noble Metal Nanoparticles, Phillip Blake

Graduate Theses and Dissertations

Chemical sensing is a key component in modern society, especially in engineering applications. Because of their widespread impact, improvements to chemical sensors are a significant area of research. One class of sensors, plasmonic sensors, is being heavily researched because of their ability to detect low levels of analyte in near real time without destroying the analyte. This work studies a new class of plasmonic sensor that utilizes diffractive coupling to improve sensor performance. Specifically, this work outlines the first study of diffractive coupling sensors with typical nanoparticle shapes. Sensitivity of this new class of sensor is directly compared to typical …

The Oxidation Of Hydrogen Peroxide On Nanostructured Rhodium Microelectrodes, N. Bartlett Philip, F. Esterle Thomas

Journal of Electrochemistry

Mesoporous Rh films were deposited onto platinum microelectrodes from the H₁ lyotropic liquid crystalline phase of C₁₂EO₈ (octaethyleneglycol monododecyl ether). The electrodes show well defined voltammetry for the oxidation and the reduction of hydrogen peroxide at low concentrations (<10 mmol•L-1) with excellent stability for operation at neutral pH. Based on the hysteresis in the current and the potential dependence the oxidation of hydrogen peroxide occurs through a CEE mechanism involving Rh(OH)₃ on the mesoporous Rh electrode surface. At higher hydrogen peroxide concentrations the current reaches a plateau that is due to either saturation of the binding sites for hydrogen peroxide or limitation of the reaction due to acidification of the solution within the pores. For the thin films (below 200 nm) the hydrogen peroxide calibration curves we …

Electrochemical Synthesis Of Silver-Tetracyanoquinodimethane Nanorods At Agar Supported Water/1,2-Dichloroethane Interface, Li Huang, Yixian Wang, Michael V. Mirkin, Bin Ren, Dongping Zhan

Journal of Electrochemistry

Silver-tetracyanoquinodimethane (AgTCNQ) is an important charge transfer salt due to its high conductivity and other electronic properties. In this communication, we report the synthesis of AgTCNQ at the liquid/liquid interface. Agar was used as a gelling agent to support water/1,2-dichloroethane (DCE) interface. Silver ions were transferred from the hydrogel into DCE phase, where they combined with TCNQ^- to form AgTCNQ nanorods. The developed method can provide a new route for synthesis of functional materials based on the electrochemistry at the liquid/liquid interface.

Optimization Of Biodiesel Production Plants, Nghi T. Nguyen

Department of Chemical and Biomolecular Engineering: Dissertations, Theses, and Student Research

A conventional biodiesel plant utilizing two distillation columns to purify unreacted reactants and products is considered in this study. Thermodynamic analyses are used to assess the performance of the existing distillation columns, and reduce the costs of operation by appropriate retrofits in a biodiesel production plant. After the retrofits, the overall exergy loss for the two columns has decreased from 2430.87 kW to 1674.12 kW.

A reactive distillation is developed for esterification of lauric acid with methanol using equilibrium and nonequilibrium models. Equilibrium modeling dominated during last few decades due to their straightforward mathematical modeling. In reality, separation depends on …

Characterization Of Heterogeneous Reaction Systems By Thermal Analysis And Mathematical Modeling, Shreya Adhikari, Chuck Tillie

Undergraduate Research Posters 2012

It is anticipated that this research will lead to scale-up parameters that can be used to model a laboratory-scale deposition furnace, and guide further experimentation to advance technologies for protective and conversion coatings.

Electrochemical Performances Of Layered Polypyrrole/Chemically Reduced Graphene Oxide Nanocomposites As Supercapacitor Electrodes, Si-Zhe Xu, Xue-Jiao Zhou, Kun Wu, Yong-Qiang Yang, Hai-Xia Wu

Journal of Electrochemistry

Nanocomposites of polypyrrole (Ppy) and chemically reduced graphene oxide (CRGO), Ppy/CRGO, have been fabricated through in-situ polymerization of pyrrole on graphene oxide (GO) sheets. The as-synthesized Ppy/CRGO composites were characterized complementarily using scanning electron microscopy (SEM), thermogravimetric analysis (TGA), and Fourier transformed infrared spectroscopy (FT-IR). By controlling the initial ratio of the GO to pyrrole, the layered composites could be obtained and their thickness could be tuned properly. The Ppy/CRGO electrodes were prepared using a mechanical compressing technique and their electrical conductivity and electrochemical properties were characterized systematically. We demonstrated that as electrodes for supercapacitor, the Ppy/CRGO composites with Ppy …

Electrocatalytic Activities Of Mb/Aunps/Mwnts/Gc Electrode For Hydrogen Peroxide Reduction, Zheng-Juan Huang, Hua-Ping Peng, Dai-Jun Cha, Ai-Lin Liu, Wei Chen, Xin-Hua Lin, Yong-Ji You

Journal of Electrochemistry

A novel matrix, multiwalled carbon nanotubes supported Au nanoparticles composite nanomaterial (AuNPs/MWNTs), for immobilization of protein and biosensing was designed using a simple and effective one-step in situ synthesis route. Using myoglobin (Mb) as a model, the direct electrochemistry of the immobilized proteins on the AuNPs/MWNTs composite was studied. The results showed that the AuNPs/MWNTs composite can maintain the bioactivity and facilitate the direct electrochemistry of Mb in the Mb/AuNPs/MWNTs/GC electrode. Based on the direct electron transfer of the immobilized Mb, the protein electrode exhibited excellent electrocatalytic activity to the reduction of H₂O₂ with a linear range …

Synthesis And Electrochemical Characterization Of Li3V2(Po4)3/C Cathode Material By Ball-Milling Assisted Microwave Method, Zhi-Yuan Tang, Wen-Feng Mao, Ji Yan, Wei Yuan, Xin-He Zhang

Journal of Electrochemistry

The cathode materials of Li₃V₂(PO₄)₃/C were successfully synthesized by ball-milling assisted microwave method and the microwave irradiation time was also optimized. It is found that the Li₃V₂(PO₄)₃/C material obtained at a microwave power of 640 W for 18 min showed the best electrochemical performance with the initial reversible capacity of 101.3 mAh·g^-1 and the remained 100.8 mAh·g^-1 at 5C rate after 300 cycles. This excellent electrochemical capability may be resulted from good crystallinity, smaller and uniform particle size of the material, showing …

Synthesis And Electrochemical Properties Of High-Capacity Cathode Material 0.08lico0.75Al0.25O2-0.92linio2, Ru-Ying Wang, Tian Qiu, Chong Mao, Wen-Sheng Yang

Journal of Electrochemistry

CoAl-LDH or Co(OH)₂ coated spherical Ni(OH)₂ precursors were obtained via a co-precipitation method at a constant pH. The mixtures of the precursors and LiOH·H₂O were annealed at high temperature in O₂ atmosphere, and then the cathode materials of 0.08LiCo_0.75Al_0.25O₂-0.92LiNiO₂, 0.08LiCoO₂-0.92LiNiO₂ and LiNiO₂ were synthesized. Effects of the coating layer were also studied. The results showed that the 0.08LiCo_0.75Al_0.25O₂-0.92LiNiO₂ material possessed the best rate and cycle life performance. The discharging capacities at 0.1C, 0.5C and 3C were …