Polymer Science Commons^™

Defining The Proper Operating Time For The Septa Extractor, Abigail Jones

Williams Honors College, Honors Research Projects

Anionic polymerizations are a common type of reaction used to produce synthetic rubber. During these reactions, it is necessary to charge initiators, modifiers, and other substances, through pressurized containers that are sealed with rubber septa. These septa prevent oxygen and moisture from entering the pressurized container, and the reactor, though they need to be cleaned before use to remove other impurities. Currently a glass Soxhlet Extractor is used to remove such impurities, and though effective, it has a limited capacity, so it has to run frequently. This limitation led to the commissioning of the Septa Extractor, which is an automated …

Anti-Freeze Double Network Hydrogels, William Gross

Williams Honors College, Honors Research Projects

Three polyethylene glycol (PEG) based crosslinkers with repeat unit nominal weights of 62.1, 200, and 400 g/mol in agar/PAM double network (DN) hydrogels were used to study the effect of different crosslinkers on thermal and mechanical properties. Using the one-pot synthesis method, hydrogels with the PEG crosslinkers or methylene-bis-acrylamide (MBAA) were made via sol-gel transition for formation of agar network, and photopolymerization of the PAM network using Irgacure 2959 as photo initiator. Tensile and compression tests were performed on as prepared, swollen, and swollen & cooled specimens of each hydrogel. Freezing time and thermal imaging were performed in -20 °C …

Utilizing Computer-Aided Molecular Design With Azido-Ester Plasticizers, Justin Ebert

Williams Honors College, Honors Research Projects

The goal of this project was to utilize Computer-Aided Molecular Design (CAMD) using the Signature molecular descriptor to inversely design optimized azido-ester plasticizers. Azido-ester plasticizers are used to modify the mechanical properties of propellant and explosive formulations. With the assistance of quantitative structure-property relationships, QSPRs, and two types of constraint equations, these new, novel plasticizers have the potential to possess optimal physical and chemical properties. Properties investigated in this work were decomposition temperature, heat of formation, glass transition temperature, and molecular weight. These properties were chosen for their importance when formulating propellants or explosives. After the filters were applied to …

Mechanisms Of Emulsion Destabilization: An Investigation Of Surfactant, Stabilizer, And Detergent Based Formulations Using Diffusing Wave Spectroscopy, Jordan N. Nowaczyk

Theses and Dissertations

Conventional approaches for studying emulsions, such as microscopy and macroscopic phase tracking, present challenges when it comes to establishing detailed mechanistic descriptions of the impact of emulsifier and stabilizer additives. Additionally, while a combination of sizing methods and macroscopic phase tracking can provide insights into droplet size changes and concentration, the use of multiple measurements can be cumbersome and error-prone. It is the focus of this work, to present a new method for studying water in oil (W/O) emulsions that involves using diffusing wave spectroscopy (DWS) to examine the impact of three different surface stabilizing additives at varying concentrations. By …

The Effect Of Different Fracturing Fluids On The Productivity Of Multi-Staged Fractured Marcellus Shale Horizontal Wells, Vida Gyaubea Matey-Korley

Graduate Theses, Dissertations, and Problem Reports (ETD)

While hydraulic fracturing has undeniably improved the production from oil and gas reservoirs, this technology is not without limitations. The primary hurdles lie in the areas of proppant transport, fluid rheology, and stress management. Despite the extensive research conducted in this domain, there remains a considerable amount of work to be done for comprehensive solutions that account for the complex interactions among fracturing fluid, proppant distribution, and geomechanical conditions. Achieving this will then make room for a holistic and efficient hydraulic fracturing strategy.

This study addresses the above-mentioned problem by examining the impact of fluid type on proppant transport and …

Development Of Polymeric Sorbents As Reusable Filtration Systems For Remediation Of Pfas Contaminated Water, E. Molly Frazar

Theses and Dissertations--Chemical and Materials Engineering

Decades of use of per- and polyfluoroalkyl substances (PFAS) in a multitude of consumer and industry-based products have led to a devastating amount of soil and water contamination. Although these chemicals and compounds possess advantageous qualities – such as that of PFAS in the role of fire-fighting foams that have no doubt saved countless lives and homes, we must take responsibility for the anthropogenic hazards that threaten our global health. This entails being able to cost-effectively remediate problems created in the past from overuse of toxic substances that could negatively impact our future, and in this case, the future of …

Mechanical And Adhesive Properties Of Supramolecular, Mussel-Inspired Hydrogels, Daniel Darby

Theses and Dissertations--Chemical and Materials Engineering

The exceptional mechanical and adhesive properties of mussel byssal threads come from supramolecular interactions of ligands found in the proteins comprising them. Ligands can form hydrophobic interactions, π-π stacking interactions, and hydrogen bonds, but the strongest supramolecular interaction they demonstrate is metal-ligand coordination. Specifically, Histidine (His-) and nitrodopamine (nDOPA) ligands coordinate to metals in a bidentate fashion and take on tris-, bis-, and mono- modalities (3, 2, or 1 ligand per ion, respectively). The distribution of these modalities is controlled by equilibrium thermodynamics. These same ligands can be used as crosslinks in supramolecular hydrogel networks. Supramolecular hydrogel networks are dissipative, …

A Novel Biomaterial Platform For Cardiac Tissue Engineering, Andrew House

Dissertations

Heart disease is one of the leading causes of death in the world. With a growing demand for in vitro cardiac models that can recapitulate the complex physiology of the cardiac tissue, there is a desire to create novel therapies and treatments. However, due to a lack of fundamental understanding of the heart's inflammatory response to myocardial infarction, the development of new therapies is both time consuming and costly. In this work, a novel approach to fabricating a dynamic hydrogel cardiac platform is reported. This platform better mimics the dynamic changes occurring in the native cardiac tissue microenvironment during cardiac …

Structure And Dynamics Of Lignin In Condensed Phase For Biomass Conversion, Nusrat Jahan

Theses and Dissertations

Lignocellulosic biomass represents the largest potential volume and lowest cost for biofuel and biochemical production. Harnessing the full potential of the lignocellulosic biomass for low-carbon energy requires the knowledge of efficient breakdown and fractionation of its carbohydrates and lignin. Organic solvent pretreatment is recognized as an emerging way ahead because of its inherent advantages, such as the ability to fractionate lignocellulosic biomass into cellulose, lignin, and hemicellulose components with high purity, as well as easy solvent recovery and solvent reuse. Through all-atom MD simulation, we analyze the conformational transition of diverse lignin molecules in varying concentration of Methanol/water , DMSO/water …

Towards High-Rate Thermoplastic Composites, Chris Croshaw

Dissertations

This dissertation attempts to identify and address the problems associated with high-rate thermoplastic composites. Herein, three primary research thrusts were investigated; the first two chapters focus on the melt-state degradation mechanism of PEKK copolymers and its role on downstream crystallization and thermomechanical properties, the third chapter examines the role of graphene nanoplatelets (GNP) on the crystallization and melting behavior of PEKK 70/30, and the final chapter focused on radio frequency and induction heating of PEKK nanocomposites.

The melt-state degradation mechanism was identified using a combination of x-ray photoelectron spectroscopy (XPS), molecular dynamics (MD), and quantum mechanics (QM) simulations. Melt-state degradation …

Programming The Properties Of Branched Polymers Through Precision Architectures, Michael R. Dearman

LSU Master's Theses

The glass transition of branched polymers is determined by multiple structural parameters that dictate their inter- and intramolecular interactions, and ultimately, their molecular packing in the amorphous phase. Here we examined the impact of side chain length, backbone length, molecular weight composition, and topology on the glass transition behavior of bottlebrush polymers. Through examining precision bottlebrush polymer libraries (PBP, ĐSC = 1.0), we find the infinite molecular weight Tg is reached at a specific brush length after which the effect of the side-chain length dominates. Being a factor more dominant than the backbone, side-chain length affects the Tg of bottlebrush …

Carbon Fibers From Bio-Based Precursors Derived From Renewable Sources, Sagar Kanhere

All Dissertations

Carbon fibers have the highest strength and modulus among all known fibers and are used as reinforcements in high-performance composites [1]. Carbon fibers also have a very low density relative to metals. Therefore, carbon fibers possess ultrahigh specific strength and modulus, which make them desirable for high-performance light-weight composites. A vast majority of commercial carbon fibers are produced from PAN precursors that are expensive, which limits the use of PAN-derived carbon fibers to aerospace applications (e.g., airplanes). However, for costsensitive applications, there is a need for low-cost, moderate performance carbon fibers. Lignin is a low-cost by-product of pulping and biorefining …

Sustainable Material For Urea Delivery Based On Chitosan Cross-Linked By Glutaraldehyde Saturated Toluene: Characterization And Determination Of The Release Rate Mathematical Model, Jayanudin Jayanudin, Retno S. D. Lestari, Indar Kustiningsih, Dandi Irawanto, Rozak Rozak, Reyonaldo L. A. Wardana, Fakhri Muhammad

Karbala International Journal of Modern Science

The aims of this study were to characterize the urea-loaded chitosan microspheres and determine the release kinetic constants and diffusion coefficients. An emulsion cross-linking method was used to prepare the urea-loaded chitosan microspheres. Urea was dissolved in a solution of chitosan then put into vegetable oil and stirred to form an emulsion. Glutaraldehyde saturated toluene (GST) was added into the emulsion dropwise while continuously stirring for the solidification process. Chitosan microspheres filled with urea were washed, dried, and then analyzed. Characterization of the urea-loaded chitosan microspheres was conducted using a scanning electron microscope (SEM), Raman spectroscopy, X-ray diffraction, and particle …

Application Of The Core Shell Model For Strengthening Polymer Filament Interfaces, Yu-Chung Lin, Aniket Raut, Yiwei Fang, Yifan Yin, David Sprouster, Tai-De Li, Guillaume Freychet, Mikhail Zhernenkov, Steve Nitodas, Jonathan Sokolov, Yuval Shmueli, Miriam Rafailovich

Advanced Science Research Center

While surface segregation has been intensively studied in thin films, relatively little has been investigated in filament geometries. In contrast to thin films, the filament surface forms a continuum, with interactions both at the free air and internal filament interface, which makes it difficult to achieve an equilibrium configuration. This asymmetry has become particularly apparent with the increasing use of additive manufacturing where entire structures are constructed via layered deposition of filamentous layers from a moving thermal nozzle. In addition, this process is highly non-equilibrated with poor thermal retention and is responsible for insufficient filament–filament interfacial fusion and internal pore …

Experimental Study On Co2-Sensitive Polyacrylamide As Potential In-Situ Sealing Agent For Co2 Leakage Pathways In Geological Storage Sites, Iris Laihmen Quan Lopez

Theses and Dissertations

As the world pushes for ‘greener’ technologies and carbon neutrality, efforts have focused on creating novel ways to mitigate humankind’s carbon footprint. Carbon capture and storage (CCS) has become a prevalent technique that has proven to be an effective long-term method to safely relocate excess carbon dioxide (CO₂) into subsurface formations. However, CCS is a newer technique which requires constant monitoring due to potential leakage pathways present in CO₂ storage sites; therefore, a preventive approach to seal leakage pathways is recommended. This dissertation explores the potential of CO₂-sensitive polyacrylamide (CO₂-SPAM) as a novel …

Development Of A New Affinity Membrane For Rapidly Purifying Non-Antibody Proteins, Friendship Edioma

All Theses

This thesis project describes the modification and evaluation of a new affinity membrane for rapid chromatographic purification of non-antibody proteins. The affinity membrane utilizes Im7/CL7 coupling technology developed by Dr. Vassylyev's lab at the University of Alabama Birmingham (UAB), licensed by TriAltus Bioscience. The behavior of the membrane was evaluated using purified CL7-tagged Cas9 as my model protein for static and dynamic binding capacity analysis.

Chapter one provides an overview on biopharmaceutical drug production process development. I discuss how protein drugs are produced, isolated, and purified from the cell supernatant after upstream phases are completed. Despite increasing demands for biologics, …

Effect Of Temperature, Catalyst Concentration And Time, On Polylactic Acid Production From Sisal Boles Juice By Ring Open Polymerization, Neema O. Msuya

Tanzania Journal of Engineering and Technology (TJET)

Polylactic acid (PLA) is a biodegradable and renewable alternative to non-biodegradable petrochemical-based polymers that is environmentally friendly and green. PLA can be made from a variety of agricultural wastes that contain sugars, such as sisal boles. This study aimed at analysing the possibility of producing PLA from lactic acid (LA) produced from sisal bole. A 2n factorial design was used to analyse the effects of temperature (160-180ºC), time (1-2 hrs) and tin octoate catalyst concentration (0.025-0.05%) on the PLA yield during polymerization. Minitab Version 20.2.0 was used to design the experiment and analyse the effects on the responses through ANOVA. …

Polymers And Composite Materials, Joshua P. Steimel

Pacific Open Texts

This text serves to cover in more detail polymer physics concepts and specifically how polymers respond from the atomistic to meter length scale. This text spans topics from polymerization chemistry, chain models, Flory-Huggins theory, viscosity, characterization techniques, self assembly, polymer dynamics, viscoelasticity, and mechanics of polymer and composite materials.

This work is licensed under a Creative Commons Attribution-NonCommerical-No Derivative Works 4.0 License.

Machine Learning Prediction Of Glass Transition Temperature Of Conjugated Polymers From Chemical Structure, Amirhadi Alesadi, Zhiqiang Cao, Zhaofan Li, Song Zhang, Haoyu Zhao, Xiaodan Gu, Wenjie Xia

Faculty Publications

Predicting the glass transition temperature (T_g) is of critical importance as it governs the thermomechanical performance of conjugated polymers (CPs). Here, we report a predictive modeling framework to predict T_g of CPs through the integration of machine learning (ML), molecular dynamics (MD) simulations, and experiments. With 154 T_g data collected, an ML model is developed by taking simplified “geometry” of six chemical building blocks as molecular features, where side-chain fraction, isolated rings, fused rings, and bridged rings features are identified as the dominant ones for T_g. MD simulations further unravel the fundamental roles …

Shape Memory Polymer Foaming With Tunable Interconnectivity Using Off-The-Shelf Foaming Components, Natalie Marie Petryk

Theses - ALL

The ability to tune pore structures of gas-blown polyurethane shape memory polymer (SMP) foams easily and safely could improve their outcomes as hemostatic dressings or tissue engineering scaffolds and overall commercialization efforts. Incorporating physical blowing agents into the polymer mix can be used to tune pore size and interconnectivity without altering foam chemistry. Enovate (HFC-254fa) is a commonly used physical blowing agent in gas-blown foams, but the Environmental Protection Agency (EPA) considers its use unacceptable because it is a hydrofluorocarbon that contributes to global warming. Here, off-the-shelf solvents accepted for use by the EPA, acetone, dimethyoxymethane (methylal), and methyl formate, …