Chemical Engineering Commons^™

Biomolecule Localization And Surface Engineering Within Size Tunable Nanoporous Silica Particles, Daniel M. Schlipf

Theses and Dissertations--Chemical and Materials Engineering

Mesoporous silica materials are versatile platforms for biological catalysis, isolation of small molecules for detection and separation applications. The design of mesoporous silica supports for tailored protein and biomolecule interactions has been limited by the techniques to demonstrate biomolecule location and functionality as a function of pore size. This work examines the interaction of proteins and lipid bilayers with engineered porous silica surfaces using spherical silica particles with tunable pore diameters (3 – 12 nm) in the range relevant to biomolecule uptake in the pores, and large particle sizes (5 - 15 µm) amenable to microscopy imaging

The differentiation of …

Fundamental Studies Of Surfactant Templated Metal Oxide Materials Synthesis And Transformation For Adsorption And Energy Applications, Saikat Das

Theses and Dissertations--Chemical and Materials Engineering

This work addresses fundamental aspects of designing templates and curing conditions for the synthesis of mesoporous metal oxide thin films. The first section addresses selection of cationic-carbohydrate surfactant mixtures to synthesize templated silica thin films for selective adsorption of simple carbohydrates based on molecular imprinting. Nuclear magnetic resonance and fluorescence spectroscopy results suggest a novel structure for mixtures of alkyl glucopyranosides or xylopyranosides with cationic (trimethylammonium) surfactants. Despite thermodynamically favorable mixing, the carbohydrate headgroups in the mixed micelle adopt an inverted configuration with their headgroups in the micelle core, and therefore are inaccessible for molecular imprinting. This orientation occurs even …

Interfacial Engineering Of Biomass Hydrolysis By Cellulase Enzymes And Mechanistic Modeling Of Hydrolysis Of Cellulose Substrates, Ravinder Kumar Garlapalli

Theses and Dissertations--Chemical and Materials Engineering

Lignocellulosic biomass is a sustainable and renewable energy resource that can be converted to fuels and other commodity chemicals, but this conversion is currently limited by its recalcitrance to enzymatic degradation. Because of this recalcitrance, the major challenges in the commercialization of enzymatic hydrolysis processes are the relatively low hydrolysis rates, limited cellulose conversion under some conditions, and high cost of enzymes.

Enzymatic hydrolysis is influenced by the structure of the biomass after pretreatment and the mode of enzyme action, but has also been shown to be enhanced by surfactant additives. The objective of this work was to elucidate the …

Evaporation-Induced Formation Of Well-Ordered Surface Patterns On Polymer Films, Wei Sun

Theses and Dissertations--Chemical and Materials Engineering

Various techniques of fabricating surface patterns of small scales have been widely studied due to the potential applications of surface patterns in a variety of areas. It is a challenge to fabricate well-ordered surface area efficiently and economically. Evaporation-induced surface patterning is a promising approach to fabricate well-ordered surface patterns over a large area at low cost. In this study, the evaporation-induced surface patterns with controllable geometrical characteristics have been constructed. The dewetting kinetics on deformable substrate is also investigated.

Using simple templates to control the geometry and the evaporation behavior of a droplet of volatile solvent, various gradient surface …

Determining The Effects Of Cd151 And Β1 On Tumor Cell Adhesion And Migration, Rachel R. Essex

Theses and Dissertations--Chemical and Materials Engineering

Previous studies have shown that the upregulation of CD151 and β₁ is associated with poor prognosis in many cancers such as breast cancer. Studies have provided evidence that these proteins are associated with the adhesion and migration of tumor cells. In this study, a microfluidic flow chamber was utilized to determine how CD151 and β₁ affected the firm and initial adhesion of metastatic breast cancer cells to a planar endothelial monolayer under shear stress. This system mimicked the adhesion of metastatic breast cancer cells to the endothelial cells of the circulatory system. CD151 and β₁ increased the …

Delivery Of A Fatty Acid Signal Via Rtil For Biofilm Dispersion, Rachaud M. Keyes

Honors Theses

A number of proposed applications for ionic liquids involve ionic liquid/water interfaces, such as, chemical separations or drug delivery systems. Therefore, an understanding of the solubility and micellar behavior of ionic liquids in an aqueous environment is critical fundamental knowledge. The long term goal of our study was ionic liquids for delivery of biological active agents; therefore, we chose the anion, bis(trifluoromethanesulfonyl)imide (Tf2N) since it promotes water stability and forms water immiscible RTILs. The study then paired the Tf2N-anion with three different classes of cations. By adding apolar substituents (-CH2-) to the cation, the size of the molecule increases in …

Design And Synthesis Of Sigma-1 Probe For Positron Emission Tomography (Pet) Imaging, May Ly

Honors Theses

Sigma-1 receptor radioligands have the potential to detect and monitor various neurological diseases. Because sigma-1 receptors are believed to be associated with numerous psychiatric conditions and neurodegenerative diseases, radioligands for sigma-1 receptors have the potential to serve as novel diagnostic tools and may be useful in assessing treatment effectiveness. A benzothiazolone 18F-labeled sigma-1 receptor ligand, CM304, has demonstrated promise as a specific positron emission tomography radiotracer for visualizing sigma-1 receptors in living subjects. Based on CM304, backup molecules were created to improve the overall drug profile, including half- life and bioavailability.

Optimization Of A Chemical Production Facility: A Study Of Operating Conditions, Equipment Sizing, And Economics Of An Ethylbenzene Production Plant., Xi Peng

Honors Theses

Economics of a chemical plant depend on multiple factors: grade of a feed, types of catalyst, operating temperature and pressure, cost of equipment, and many other factors could have influences on economics of the plant. In a previous study about an ethylbenzene facility, our team scrutinize two proposed changes. An optimization plan is recommended by our team in order to maximize the net present value (NPV) of the plant. This report focuses on demonstrating rationales of setting certain operating conditions, showcasing the details of optimization, and elucidating the reasons behind applying these modifications. The team used simulating software PRO/-II to …

Optimization: A Perspective On Improving An Ethylbenzene Production Design, Derrick C. Marchant

Honors Theses

The goal of optimization in a chemical process or system involves improving an existing design or a combination of devices. In the case of an established process such as the ethylbenzene production process investigated here, the optimization involves improving an established process and choosing the best available case within a set of constraints that also considers maximizing the economic bottom line. An objective function must be selected for an optimization problem which defines the achievable goal. The objective function of the optimization process presented here is to minimize the estimated annual operating cost (EAOC). An EAOC takes in to account …

Optimization Of An Ethylbenzene Process, Garrison Padgett Morgan

Honors Theses

In industry, chemical plants should be running at optimal performance in order to maximize profit. However, this is frequently not the case. Optimization is the process of improving an existing situation, device, or, in the case of chemical engineers, a chemical process. Furthermore, there are numerous strategies to optimize a chemical process, and it is up to the engineer to decide what to change in order to make the optimization worthwhile. Last semester, I was able to show my knowledge of optimization by applying changes to an existing ethylbenzene producing plant. I simulated the base case for this plant and …

Investigation Of Lost Circulation Materials Impact On Fracture Gradient, Mortadha Turki Alsaba

Doctoral Dissertations

"Lost circulation is a challenging problem to be prevented or mitigated during drilling. Lost circulation treatments are widely applied to mitigate losses using a corrective approach or to prevent losses using preventive approaches, also known as "wellbore strengthening". The disagreement among the different wellbore strengthening theories and the lack of understanding the strengthening mechanism resulted in the absence of a standardized method to evaluate the effectiveness of lost circulation materials (LCM) for wellbore strengthening application.

An extensive experimental investigation was performed by constructing a high pressure LCM test apparatus to investigate the effects of different parameters on the sealing efficiency …

Transition Metal Carbide (Tmc) Novel Materials For Novel Catalytic Applications, Svetlana Lagoykina

Open Access Theses & Dissertations

Transition metal carbides (TMC) constitute a diverse class of materials and traditionally have many technological applications. TMC became a subject of extensive research since 1973, when their platinum -like properties were discovered. They demonstrated high catalytical activity and selectivity in a variety of chemical reaction and have potential for some novel catalytic application.

This research is an effort to design new high effective, selective and stable bimetal or alkali promoted TMC catalyst. After extensive theoretical research a wide range of TMC, including bimetal and alkali promoted carbides, were synthesized by different methods. All solids were characterized by XRD and microscopy. …

Characterization Of Kendex® 0834 (Heavy Resins) & Kendex® 0897 (Light Resins), Victor Correa

Open Access Theses & Dissertations

Characterization of crude oil and some of its refined products has always been a challenge in the refining industry. This is mainly due to the high molecular complexity of crude oil. In this research, Heavy and Light Resins extracted from Penn Grade crude oil were analyzed with a wide variety of techniques, ranging from X-Ray Diffraction, Electron Microscopy, Fourier Transformed Infrared, C-13 Nuclear Magnetic Resonance, and chromatographic methods. An asphaltene extraction protocol was performed on both products. Only the Heavy Resin sample yielded a low amount of asphaltene. Results show that both Resins have a high degree of carbon branching, …

Transition States And Modeling For Co9s8/Mos2 Catalysis, Gabriel Angel Gonzalez

Open Access Theses & Dissertations

Transition state computational studies of the sulfur removal from dibenzothiophene (DBT) molecule have herein been performed considering the Co9S8/MoS2 interface existing on unsupported Co/MoS2 catalysts. The linear synchronous transit (LST) and quadratic synchronous transit (QST) methods integrated in a density functional theory (DFT) program such as Dmol3 were used for the calculations of energy barriers of the transition states. Three different configurations present on the Co9S8/MoS2 interface have been envisaged as possible catalytic sites: sulfur-sulfur (S, S) sites, and molybdenum-sulfur (Mo, S) and molybdenum-molybdenum (Mo, Mo) edge sites. This study revealed that the (Mo, Mo) edge site is the most …

Selective Synthesis And Characterization Of Single-Site Hy Zeolite-Supported Rhodium Complexes And Their Use As Catalysts For Ethylene Hydrogenation And Dimerization, Konstantin Khivantsev

Theses and Dissertations

Single-site Rh(CO)2, Rh(C2H4)2 and Rh(NO)2 complexes anchored on various dealuminated HY zeolites can be used as precursors for the selective surface mediated synthesis of well-defined site-isolated Rh(CO)(H)x complexes. DFT calculations and D2 isotope exchange experiments provide strong evidence for the formation of a family of site isolated mononuclear rhodium carbonyl hydride complexes (including the first examples of RhH complexes with undissociated H2 ligands): Rh(CO)(H2), Rh(CO)(H)2, and Rh(CO)(H). The fraction of each individual complex formed varies significantly with the Si/Al ratio of the zeolite and the nature of the precursor used.

HY zeolite-supported mononuclear Rh(CO)2 complexes are remarkably active in ethylene …

Multi-Platform Arabinoxylan Scaffolds As Potential Wound Dressing Materials, Donald C. Aduba Jr

Theses and Dissertations

Biopolymers are becoming more attractive as advanced wound dressings because of their naturally derived origin, abundance, low cost and high compatibility with the wound environment. Arabinoxylan (AX) is a class of polysaccharide polymers derived from cereal grains that are primarily used in food products and cosmetic additives. Its application as a wound dressing material has yet to be realized. In this two-pronged project, arabinoxylan ferulate (AXF) was fabricated into electrospun fibers and gel foams to be evaluated as platforms for wound dressing materials. In the first study, AXF was electrospun with varying amounts of gelatin. In the second study, AXF …

The Synthesis Of Solid Supported Palladium Nanoparticles: Effective Catalysts For Batch And Continuous Cross Coupling Reactions, Kendra W. Brinkley

Theses and Dissertations

Catalysis is one of the pillars of the chemical industry. While the use of catalyst is typically recognized in the automobile industry, their impact is more widespread as; catalysts are used in the synthesis of 80% of the US commercial chemicals. Despite the improved selectivity provided by catalyst, process inefficiencies still threaten the sustainability of a number of synthesis methods, especially in the pharmaceutical industry. Recyclable solid supported catalysts offer a unique opportunity to address these inefficiencies. Such systems coupled with continuous synthesis techniques, have the potential to significantly reduce the waste to desired product ratio (E-factor) of the production …

Measurements And Modeling Of Hydrocarbon Mixture Fluid Properties Under Extreme Temperature And Pressure Conditions, Babatunde A. Bamgbade

Theses and Dissertations

Knowledge of thermodynamic fluid properties, such as density and phase behavior, is important for the design, operation, and safety of several processes including drilling, extraction, transportation, and separation that are required in the petroleum. The knowledge is even more critical at extreme temperature and pressure conditions as the search for more crude oil reserves lead to harsher conditions. Currently, there is dearth of experimental data at these conditions and as such, the predictive capability of the existing modeling tools are unproven. The objective of this research is to develop a fundamental understanding of the impact of molecular architecture on fluid …

Integrated Nanoscale Imaging And Spatial Recognition Of Biomolecules On Surfaces, Congzhou Wang

Theses and Dissertations

Biomolecules on cell surfaces play critical roles in diverse biological and physiological processes. However, conventional bulk scale techniques are unable to clarify the density and distribution of specific biomolecules in situ on single, living cell surfaces at the micro or nanoscale. In this work, a single cell analysis technique based on Atomic Force Microscopy (AFM) is developed to spatially identify biomolecules and characterize nanomechanical properties on single cell surfaces. The unique advantage of these AFM-based techniques lies in the ability to operate in situ (in a non-destructive fashion) and in real time, under physiological conditions or controlled micro-environments.

First, AFM-based …

Polysaccharide-Based Shear Thinning Hydrogels For Three-Dimensional Cell Culture, Vasudha Surampudi

Theses and Dissertations

The recreation of the complicated tissue microenvironment is essential to reduce the gap between in vitro and in vivo research. Polysaccharide-based hydrogels form excellent scaffolds to allow for three-dimensional cell culture owing to the favorable properties such as capability to absorb large amount of water when immersed in biological fluids, ability to form “smart hydrogels” by being shear-thinning and thixotropic, and eliciting minimum immunological response from the host. In this study, the biodegradable shear-thinning polysaccharide, gellan-gum based hydrogel was investigated for the conditions and concentrations in which it can be applied for the adhesion, propagation and assembly of different mammalian …