Chemical Engineering Commons^™

Understanding The Effect Of Balance Of Plant Contaminants On Pemfcs Performance: Models, Mechanisms, Functional Group, Hyun-Seok Cho

Theses and Dissertations

This dissertation considers contamination of a proton exchange membrane fuel cell (PEMC) that may result from chemicals that leach from balance of plant (BOP) materials. Both model predictions and experimental data are presented. The model is used to predict the cathode contamination impact on the Pt/C electrode and the membrane assuming no transport of contaminant from cathode to anode. The model prediction accounts for the contamination mechanisms such as adsorption, ion-exchange, absorption and three sources of voltage (i.e., performance) loss. The simple 2-D time-dependent model is developed by considering well known chemical engineering concepts of Langmuir adsorption, partition coefficients, plug …

Enantioselective Hydrogenation Of Α-Methylcinnamic Acid Over Pd/Al2o3: A Spectroscopic And Kinetic Study, Xiaojing Sun

Theses and Dissertations

Hydrogenation of C=C in α-methylcinnamic acid (MCA) is studied by both kinetic and spectroscopic method. Kinetic study was in a semi-batch reactor. The reaction activity is strongly solvent dependent, while selectivity remains almost unaffected. The reaction is zero order in hydrogen pressure and first order in MCA. The presence of cinchonidine does not affect the reaction order with respect to either acid or H2 pressure, but has a significant inhibiting effect on the reaction rate. The catalyst exhibits stable activity during the reaction with no sign of deactivation. The adsorption and hydrogenation in dichloromethane, isopropanol and 1, 4-Dioxane over the …

Rational Design Of Perovskite Based Anode Materials For Solid Oxide Fuel Cells: A Computational Approach, Suwit Suthirakun

Theses and Dissertations

A key challenge in the development of solid oxide fuel cell (SOFC) technology is related to finding a suitable replacement for Ni-based cermet anodes. Although conventional Ni-based electrodes exhibit excellent catalytic activity and current collection, they suffer from several limitations such as instability upon redox cycling, nickel sintering, and sulfur and carbon poisoning when exposed to practical hydrocarbon fuels. Therefore, alternative anode materials need to be developed for SOFCs. Among the novel anode electrodes, perovskite based materials are of great interest because they have been shown to satisfy most intrinsic SOFC anode requirements such as high thermodynamic stability in anodic …

Applications Of High Throughput (Combinatorial) Methodologies To Electronic, Magnetic, Optical, And Energy-Related Materials, Martin L. Green, Ichiro Takeuchi, Jason R. Hattrick-Simpers

Faculty Publications

High throughput (combinatorial) materials science methodology is a relatively new research paradigm that offers the promise of rapid and efficient materials screening, optimization, and discovery. The paradigm started in the pharmaceutical industry but was rapidly adopted to accelerate materials research in a wide variety of areas. High throughput experiments are characterized by synthesis of a “library” sample that contains the materials variation of interest (typically composition), and rapid and localized measurement schemes that result in massive data sets. Because the data are collected at the same time on the same “library” sample, they can be highly uniform with respect to …

Capacity Fade Model For Spinel Limn2O4 Electrode, Yiling Dai, Long Cai, Ralph E. White

Faculty Publications

A mathematical model for the capacity fade of a LiMn₂O₄ (LMO) electrode is developed in this paper by including the acid attack on the active material and the solid electrolyte interphase (SEI) film formation on the LMO particle surface. The acid generated by the LiPF₆ and the solvent decompositions are coupled to the manganese (Mn) dissolution. The decrease of the Li ion diffusion coefficient is involved as another contribution to the capacity fade, which is caused by the passive film formation on the active material surface. The effects of cell practical operation/fabrication conditions and kinetics of …

Methane Hydrate Formation Under Different Surfactants, Mohammad Mahmud

Dissertations and Theses

No abstract provided.

Photocrosslinked Methylcellulose Hydrogels For Controlled Protein Release, Das Dritiman

Dissertations and Theses

No abstract provided.

Drug Treatment Of Kidney Clip-Induced Hypertension In Rats; Peroxidase Tracer Spot Frequency In Rat Aorta After Chemically Induced Apoptosis, Simon Kleinbart

Dissertations and Theses

No abstract provided.

Synthesis Of 4-Azidocoumarins And Their Use In Copper-Catalyzed Azide-Alkyne Cycloaddition Reactions, Anthony J. Netsuri

Dissertations and Theses

Triazole-containing compounds have shown great biological activity ranging from antiviral, antibacterial, to anticancer, to name a few. Coumarin derivatives have also shown interesting biological activities. The combination of these bioactive compounds appears to have great promise for new and future medicines. In this work, various 4-azido-coumarins were synthesized via the transformation of the 4-hydroxy derivatives to 4-benzotriazolyloxy coumarins by reaction with the peptide coupling agent (benzotriazol-1-yloxy)tris-(dimethylamino)phosphonium hexafluorophosphate (BOP), and 1,8-diazabicycloundec-7-ene (DBU) as the base, in tetrahydrofuran (THF) solvent. The 4-benzotriazolyloxy coumarins were converted to the 4-azidocoumarins by reaction with sodium azide (NaN3), and the overall process was simplified to a …

Induction Of Microalgal Lipids For Biodiesel Production In Tandem With Sequestration Of High Carbon Dioxide Concentration, Wilbel J. Brewer

Dissertations, Master's Theses and Master's Reports - Open

There is no doubt that sufficient energy supply is indispensable for the fulfillment of our fossil fuel crises in a stainable fashion. There have been many attempts in deriving biodiesel fuel from different bioenergy crops including corn, canola, soybean, palm, sugar cane and vegetable oil. However, there are some significant challenges, including depleting feedstock supplies, land use change impacts and food use competition, which lead to high prices and inability to completely displace fossil fuel ^[1-2]. In recent years, use of microalgae as an alternative biodiesel feedstock has gained renewed interest as these fuels are becoming increasingly economically viable, …

Selective Mercury Sequestration From A Silver/Mercury Cyanide Solution, Kristen L. Gabby

Dissertations, Master's Theses and Master's Reports - Open

Silver and mercury are both dissolved in cyanide leaching and the mercury co-precipitates with silver during metal recovery. Mercury must then be removed from the silver/mercury amalgam by vaporizing the mercury in a retort, leading to environmental and health hazards. The need for retorting silver can be greatly reduced if mercury is selectively removed from leaching solutions.

Theoretical calculations were carried out based on the thermodynamics of the Ag/Hg/CN- system in order to determine possible approaches to either preventing mercury dissolution, or selectively precipitating it without silver loss. Preliminary experiments were then carried out based on these calculations to determine …

Electrospun Quaternized Chitosan Fibers For Virus Removal From Drinking Water, Xue Mi

Dissertations, Master's Theses and Master's Reports - Open

Membrane filtration has become an accepted technology for the removal of pathogens from drinking water. Viruses, known to contaminate water supplies, are too small to be removed by a size-exclusion mechanism without a large energy penalty. Thus, functionalized electrospun membranes that can adsorb viruses have drawn our interest. We chose a quaternized chitosan derivative (HTCC) which carries a positively-charged quaternary amine, known to bind negatively-charged virus particles, as a functionalized membrane material. The technique of electrospinning was utilized to produce nanofiber mats with large pore diameters to increase water flux and decrease membrane fouling. In this study, stable, functionalized, electrospun …

Sustainable Energy Production In The United States: Life Cycle Assessment Of Biofuels And Bioenergy, Jiqing Fan

Dissertations, Master's Theses and Master's Reports - Open

The United States of America is making great efforts to transform the renewable and abundant biomass resources into cost-competitive, high-performance biofuels, bioproducts, and biopower. This is the key to increase domestic production of transportation fuels and renewable energy, and reduce greenhouse gas and other pollutant emissions.

This dissertation focuses specifically on assessing the life cycle environmental impacts of biofuels and bioenergy produced from renewable feedstocks, such as lignocellulosic biomass, renewable oils and fats. The first part of the dissertation presents the life cycle greenhouse gas (GHG) emissions and energy demands of renewable diesel (RD) and hydroprocessed jet fuels (HRJ). The …

Production Of Recombinant Trichoderma Reesei Endoglucanase Protein Cel7b By Using Kluyveromyces Lactis, Zainab Ibrahim Alshoug

Dissertations, Master's Theses and Master's Reports - Open

This research is about producing recombinant Trichoderma reesei endoglucanase Cel7B by using Kluyveromyces lactis, transformed with chromosomally integrated Cel7B cDNA, as a host cell (K. lactis Cel7B). Cel7B is one of the glycoside hydrolyze family of proteins that are produced by T. reesei. Cel7B together with other endoglucanases, exoglucanases, and â-glucosidases hydrolyze cellulose to glucose, which can then be fermented to biofuels or other value-added products.

The research objective of this MS project is to examine favorable fermentation conditions for recombinant Cel7B enzyme production and improved activity. Production of enzyme on different types of media was examined, and the activity …

A Novel Approach To Carbon Dioxide Capture And Storage, Brett P. Spigarelli

Dissertations, Master's Theses and Master's Reports - Open

The novel approach to carbon capture and storage (CCS) described in this dissertation is a significant departure from the conventional approach to CCS. The novel approach uses a sodium carbonate solution to first capture CO₂ from post combustion flue gas streams. The captured CO₂ is then reacted with an alkaline industrial waste material, at ambient conditions, to regenerate the carbonate solution and permanently store the CO₂ in the form of an added value carbonate mineral. Conventional CCS makes use of a hazardous amine solution for CO₂ capture, a costly thermal regeneration stage, and the underground storage …

Computational Prediction Of The Sporulation Network In Clostridium Thermocellum, Changyi Jiang

Dissertations, Master's Theses and Master's Reports - Open

Sporulation is a process in which some bacteria divide asymmetrically to form tough protective endospores, which help them to survive in a hazardous environment for a quite long time. The factors which can trigger this process are diverse. Heat, radiation, chemicals and lacking of nutrition can all lead to the formation of endospores. This phenomenon will lead to low productivity during industrial production. However, the sporulation mechanism in a spore-forming bacterium, Clostridium theromcellum, is still unclear. Therefore, if a regulation network of sporulation can be built, we may figure out ways to inhibit this process. In this study, a …

Comparison Of Square Root Of Time Approach And Statistical Approach To Minimize Subjectivity In The Determination Of Minimum In-Situ Stress, Soumitra Bhaskar Nande

Masters Theses

"A formation's minimum in-situ stress is an important parameter to determine for hydraulic fracturing. While minimum in-situ stress, and its orientation, can be measured from triaxial tests on core, it is more common to measure it as closure stress, by performing pressure testing of wells in the field. Closure stress is considered equal to, or a good approximation of the minimum in-situ stress for most cases. The analytical methods applied to such pressure testing include the square root of time plot, G function plot and the G-dP/dG plot. These plots require the engineer to fit tangent lines to the data, …

Kinetics Of Human And Bovine Insulin Amyloid Fibril Formation In The Presence Of Solid/Liquid Interfaces, Paulina Barranco Morales

Masters Theses

"The purpose of this thesis was to study the rate and extent of aggregation of human and bovine insulin in bulk and in the presence of either polystyrene microspheres with different surface chemistries or liposomes of different composition. Insulin aggregation was followed by turbidimetry, Fourier transform infrared spectroscopy (FTIR), and dynamic light scattering. The Congo red assay was used to corroborate the presence of amyloid deposits and transmission electron microscopy (TEM) was used to analyze the morphology of the amyloid deposits. Our results show that not all the surfaces shortened the lag time. On the other hand, most surfaces had …

Protein Aggregation At Solid/Liquid Interfaces: A Monte Carlo Study With Explicit And Implicit Solvent Effects, Rehman Fazeem

Masters Theses

"Metropolis Monte Carlo (MC) simulations were performed with positively charged peptides in aqueous solution to study changes in peptide conformations at solid/liquid interface, and its effects on protein aggregation. Intermediate-resolution diblock model peptide, comprising of 10 units of ALA (non-polar) and LYS (polar) amino acid residues, was used for the simulations. In the first approach to modeling, solvent effects were considered explicitly. The explicit model was then used to study two peptide molecules, in helical structure, at solid/liquid interface. In order to increase the number of peptide molecules in the simulation box, with reduced computational cost, an implicit solvent model …

Computational Fluid Dynamics Flow Comparison Between Openhole Sleeve And Plug-And-Perf Completion In A Hydraulic Fractured Horizontal Well, Viriyah Theppornprapakorn

Masters Theses

"Multi-stage hydraulic fracture completions in horizontal wells have facilitated economic development of natural gas from unconventional and tight gas reservoirs.Industry has relied on two horizontal multi-stage completion technologies: cemented and perforated liner or Plug-and-perf method and Openhole Sleeve Multi-stage method. Each method has its own advantages and disadvantages. However, one of the most important questions is which method yields better gas production? Computation fluid dynamics (CFD) is a powerful tool for solving complex fluid flow problems. In well completion design, CFD plays a significant role aiding the completion engineers on making decision on well completion methods. In this study, a …

Gas And Water Flow Through Nanoscale Porous Media, Songyuan Liu

Masters Theses

"This work provides a lab experiment to describe the fluid diffusion in nanoscale porous media. By using ideal ceramic membranes which have uniform pore size in nanoscale and homogeneous pore distribution instead of shale or tight sandstone which have various pore sizes and complicated pore distribution and structure, a better understanding of fluid flow through nanoscale porous media could be gained.

Core flooding test were conducted by injecting nitrogen and water separately to describe gas and liquid flow in nanoscale porous media. With all the other factors known or controlled, pressure and flow rate were measured to calculate permeability. By …

Comparison Of Class Ii Injection Well Area Of Review Requirements With Area Of Evaluation For Hydraulically Fractured Wells, Yashesh Jitendra Panchal

Masters Theses

"Since 2010 the US Environmental Protection Agency (EPA) has been proposing plans to study, and has now initiated research regarding the potential impact of hydraulic fracturing processes on drinking water sources. Their work refers to an 'Area of Evaluation' around a hydraulically fractured well, inferring that the wells immediately around hydraulic fractured wells should be studied, to evaluate the conditions of these wells and their potential to contaminate overlying USDWs. Class II injection wells must have a minimum 1/4 mile radius area of review to determine the condition of wells surrounding the proposed injection well. All wells within this AOR …

Robust Methods For Construction Of Global Potential Energy Surfaces, Phalgun Lolur

Masters Theses

"This thesis is about the development of robust methods for construction of global potential energy surfaces to study the spectroscopy and dynamics of molecular systems. A potential energy surface represents the electronic energy of a molecule as a function of its geometry. This is central to how chemists view molecular systems in terms of motion across a rich energy landscape where barriers separate wells corresponding to different stable structures. The range of molecular distortions defines the potential energy surface. Computing the potential energy surface of a molecule has become a fundamental operation in modern theoretical chemistry studies. The Born-Oppenheimer approximation …

Tensile Failure During Structural Development Of Single-Layer Buckle Folds, Xiaolong Liu

Masters Theses

"Folds and fold trains of sedimentary strata are among the most common structural traps systems for hydrocarbon reservoirs. The existence of tensile fractures associated to buckle folding is associated to the distribution of extensional strain in the outer arc of the fold hinges. This study investigates the conditions under which tensile stresses develop due to buckling in a realistic in situ stress scenario. By applying a 2D finite element modeling approach, the influence of realistic mechanical stratigraphy (including strain rate, overburden depth, competence contrasts, viscosity, and permeability) on the development of single-layer buckle folds with Newtonian viscous rheology is studied. …

Applications Of Antioxidant And Anti-Inflammatory Polymers To Inhibit Injury And Disease, David B. Cochran

Theses and Dissertations--Chemical and Materials Engineering

There is an undeniable link between oxidative stress, inflammation, and disease. Currently, approaches using antioxidant therapies have been largely unsuccessful due to poor delivery and bioavailability. Responding to these limitations, we have developed classes of polymer and delivery systems that can overcome the challenges of antioxidant and anti-inflammatory therapy. In our initial studies, nanoparticles of poly(trolox), a polymeric form of trolox, were surface-modified with antibodies. This modification allows for specific targeting to endothelial cells, affording controllable and localized protection against oxidative stress. We have shown these targeted nanoparticles bind, internalize, and provide protection against oxidative stress generation and cytotoxicity from …

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 …

Characterization Of And Controlling Morphology Of Ultra-Thin Nanocomposites, Guy C. Laine

Theses and Dissertations--Chemical and Materials Engineering

Ultrathin film nanocomposites are becoming increasingly important for specialized performance of commercial coatings. Critical challenges for ultrathin film nanocomposites include their synthesis and characterization as well as their performance properties, including surface roughness, optical properties (haze, refractive index as examples), and mechanical properties. The objective of this work is to control the surface roughness of ultrathin film nanocomposites by changing the average particle size and the particle volume fraction (loading) of monomodal particle size distributions. This work evaluated one-layer and two-layer films for their surface properties. Monodispersed colloidal silica nanoparticles were incorporated into an acrylate-based monomer system as the model …

Chme 223: Chemical Engineering Thermodynamics I—A Peer Review Of Teaching Project Benchmark Portfolio, Hossein Noureddini

UNL Faculty Course Portfolios

This portfolio was intended to provide a broad overview of the course. Initially, when I decided to write this portfolio my intention was for it to help me in the student's outcome assessment of teaching for the course and in a broader scope, for my department's effort in establishing a systematic student outcome assessment process. However, as I became more familiar with the program I realized other aspects of the course could also benefit from this portfolio. My goal for this portfolio is to be broad with emphasis on course objectives, delivery methods and their assessment. I like for this …

Ultrasound For Improved Crystallisation In Food Processing, N. Misra, Navneet Deora, Brijesh Tiwari, Patrick J. Cullen

Articles

Within the food industry, controlling crystallisation is a key factor governing food structure, texture and consumer appeal, with some foods requiring the promotion of crystallisation in a controlled manner (e.g. chocolate) and others a check (e.g. in honey). Sonocrystallisation is the application of ultrasound energy to control the nucleation of a crystallisation process. The use of power ultrasound provides a non-invasive approach to producing crystals with desired properties. Sonocrystallisation facilitates process control, primarily by modulating crystal size distribution and morphology. This paper details the governing mechanisms of sonocrystallisation. Proven and potential applications of the process in foods, including chocolates, honey, …

Novel Copper (Ii) Mediated Transfection Nano-Systems And Biological Properties Of Pyridinium Surfactants, Sarit Pal

Open Access Theses & Dissertations

Efficacy of gene therapy is relied upon the improvement of gene delivery vectors into mammalian cells. Although viral-based polynucleotide carriers are still considered as the most common method for gene delivery but the cost effectiveness, nonspecific lethal immune response has evoked the renaissance of non-viral synthetic delivery systems. An initial discovery by Felgnar et al showed Cationic Liposomes (CLs) (having an overall positive charge) when mixed with DNA to form CL-DNA complexes can enhance the transfer of polynucleotides into cells followed by its expression. Presently, a flurry of experimental works is taking place for the better understanding of structural characterization …