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Molecular Understanding Of Zwitterions And Quantum Computing For Sustainability, Manh Tien Nguyen 2023 University of Kentucky

Molecular Understanding Of Zwitterions And Quantum Computing For Sustainability, Manh Tien Nguyen

Theses and Dissertations--Chemical and Materials Engineering

The sustainable development of society needs sustainable energy solutions and the mitigation of greenhouse gas emissions. One key subject in this area is the development of safe and efficient ion-based batteries. Moreover, CO2 capture is a crucial pathway in mitigating emissions from the combustion of fossil fuels. Ongoing efforts are to improve both technologies' safety and efficiency. This thesis presents our efforts to conduct computational research on understanding advanced zwitterionic electrolytes and CO2 capture. Chapters 2-4 illustrate the computational research to understand ionic solvation in zwitterionic electrolytes. Solid-state electrolytes are essential for safer batteries. While solid polymer electrolytes …


Temperature-Dependent Diffusion In Block Copolymer Organogels, Ridwana Bashar 2023 Bucknell University

Temperature-Dependent Diffusion In Block Copolymer Organogels, Ridwana Bashar

Master’s Theses

Organogels are often considered for transport-based applications such as transdermal drug delivery vehicles and gel actuators due to their unique properties. Recent consideration of styrenic block copolymer based organogels’ application in transdermal drug delivery requires an extensive investigation of drug diffusion behavior through these gels to assess their applicability. Temperature is a major influencing parameter on diffusion. The goal of this research is to better understand the impact of temperature on diffusion in styrenic triblock copolymer organogels. To accomplish this goal, we focused on three specific objectives: (i) accurately measure the diffusivities of a solute – AOT reverse micelles – …


Impact Of Spallation And Internal Radiation On Fibrous Ablative Materials, Raghava Sai Chaitanya Davuluri 2023 University of Kentucky, Lexington

Impact Of Spallation And Internal Radiation On Fibrous Ablative Materials, Raghava Sai Chaitanya Davuluri

Theses and Dissertations--Mechanical Engineering

Space vehicles are equipped with Thermal Protection Systems (TPS) that encounter high heat rates and protect the payload while entering a planetary atmosphere. For most missions that interest NASA, ablative materials are used as TPS. These materials undergo several mass and energy transfer mechanisms to absorb intense heat. The size and construction of the TPS are based on the composition of the planetary atmosphere and the impact of various ablative mechanisms on the flow field and the material. Therefore, it is essential to quantify the rates of different ablative phenomena to model TPS accurately. In this work, the impact of …


Operation And Preliminary Energy Balance Of A Portable Kelp Dryer In Maine, Tuqa Al-Asadi 2022 University of Maine

Operation And Preliminary Energy Balance Of A Portable Kelp Dryer In Maine, Tuqa Al-Asadi

Electronic Theses and Dissertations

Seaweed (macroalgae) is a marine resource that has a high economic value. Seaweeds are important commodities as raw material for food or additives and as a source of biomass. One popular species of seaweed is Sugar kelp (Saccharina latissima) – a brown algae that is native to the Maine coast and also a commonly farmed species. It is a rich source of fibers, vitamins, minerals, and antioxidants. Seaweeds are highly perishable due to their high moisture content and will spoil quickly if not preserved, therefore a common practice is to dry the product to prolong storage life and to minimize …


Scale Modeling Of An Appearance Of Downwash Pattern Of Hot Smoke Ejected From Chimney In The Turbulent Cross Flow, Xangpheuak Inthavideth, Nobumasa Sekishita, Sounthisack Phommachanh, Yuji Nakamura 2022 Toyohashi University of Technology

Scale Modeling Of An Appearance Of Downwash Pattern Of Hot Smoke Ejected From Chimney In The Turbulent Cross Flow, Xangpheuak Inthavideth, Nobumasa Sekishita, Sounthisack Phommachanh, Yuji Nakamura

Progress in Scale Modeling, an International Journal

This study aims to elucidate the scaling law to provide the critical condition on appearance of the downwash pattern of the hot smoke ejected from a chimney in a turbulent cross flow. A specially designed wind tunnel with an active turbulence generator developed by Makita was adopted to offer a quasi-isotropic turbulence field in a lab-scale test facility. A heated jet with smoke is issued into the cross flow from the vertically oriented chimney placed in the test section of the wind tunnel. In this study, the experimental parameters considered are temperature of the heated jet (smoke), jet ejected velocity, …


Method For Routine Density Measurement Of Sublimating Solid Carbon Dioxide (Dry Ice) For Cold-Chain Quality Control, Kimberly Hafner, Bruce A. Welt, William Pelletier 2022 University of Florida

Method For Routine Density Measurement Of Sublimating Solid Carbon Dioxide (Dry Ice) For Cold-Chain Quality Control, Kimberly Hafner, Bruce A. Welt, William Pelletier

Journal of Applied Packaging Research

With recent development of vaccines and biologics, interest in dry ice for cold chain shipping has increased. However, understanding of how dry ice properties relate to performance is not well understood. This study introduces a simple method for measuring a key property of dry ice that has been shown to correlate to performance. The method involves a variant of the water displacement method for determining volume, where dense solid particles are used in place of water for volume determination. Three particle types (sieved sand, glass beads, and stainless-steel shot) were tested for suitability with the particle displacement method. Items of …


Electric Field Driven Co-Assembly And Transport Of Colloids Using Active-Passive Interaction, Brishty Deb Choudhury 2022 Louisiana State University and Agricultural and Mechanical College

Electric Field Driven Co-Assembly And Transport Of Colloids Using Active-Passive Interaction, Brishty Deb Choudhury

LSU Master's Theses

Over the past few decades, the out-of-equilibrium transport and assembly of colloidal particles have been drawing significant interest due to their myriad applications in biology, engineering, and physics. In the absence of any external force, micro and nanoparticles perform Brownian motion in dispersion and are termed as passive colloids. In contrast, active colloids are a class of particles where a net imbalance of fluid flow around their surface drives their net migration in space when subjected to an external electric field. While several studies have shown the ability to program the dynamics of active colloids using an external electric field, …


Accelerated Catalyst Diffusion In Chemically Amplified Resists, Christopher M. Bottoms 2022 University of Tennessee, Knoxville

Accelerated Catalyst Diffusion In Chemically Amplified Resists, Christopher M. Bottoms

Doctoral Dissertations

Quantitative reaction-diffusion models are critical for the development of high-resolution lithographic processes based on chemically amplified resists (CARs). CARs consist of a glassy polymer resin with a photoacid generator. Patterns are formed through a coupled reaction-diffusion process. It is known that reaction kinetics is controlled by the slow diffusion of acid-anion pairs (catalysts), and catalyst diffusion lengths partly control the pattern resolution and uniformity. However, it is difficult to quantify the diffusivity during reaction, let alone examine the roles of polymer-ion and ion-ion interactions on catalyst mobility, using direct measurements. This work presents a concerted experimental and computational effort to …


Diffusion Of A Salt In An Aqueous Media, Aldaly Pineda Hernandez 2022 University of Arkansas, Fayetteville

Diffusion Of A Salt In An Aqueous Media, Aldaly Pineda Hernandez

Chemical Engineering Undergraduate Honors Theses

Diffusion is defined as the net transfer of a molecule from a high concentration region to a low concentration region. The concept of diffusion is used in a very important process called "desalination." Desalination is a separation process used to reduce the salt content dissolved in brackish water to make it suitable for human consumption, irrigation, and industrial use.

In desalination plants, it is important to monitor the constantly changing salt content of water, partly due to the diffusive effect. The main purpose of this experiment was to study the diffusion of NaCl in water at two NaCl concentrations. The …


Free Convection Heat Transfer From Plates, Alexa Moreno 2022 University of Arkansas, Fayetteville

Free Convection Heat Transfer From Plates, Alexa Moreno

Chemical Engineering Undergraduate Honors Theses

The purpose of this honors thesis is to create an experiment for the CHEG Lab I course. This report explains the motivation for creating this heat convection experiment, the results of performing the experiment, and provides recommendations for future work on this experiment. Multiple experiments were performed to assess materials and parameters to be investigated. It was determined that a 0.5” plate has smaller percent error and accommodates for the desired timeframe for a Lab I experiment compared to the first plate used (1.5” thickness). Recommendations for expanding on this project include adding experiments using vertical geometry for heat convection …


Fate And Transport Of Toxoplasma Gondii Oocysts In Saturated Porous Media: Effects Of Electrolytes And Natural Organic Matter, Christian Pullano 2022 Clemson University

Fate And Transport Of Toxoplasma Gondii Oocysts In Saturated Porous Media: Effects Of Electrolytes And Natural Organic Matter, Christian Pullano

All Theses

Toxoplasma gondii is a pathogenic microorganism that is currently a threat to public health. Understanding the fate and transport of T. gondii through the soil and groundwater is vital in determining the risk it poses to water resources and human health. The physico-chemical interactions between the groundwater and the bio colloid within an aquifer will dictate its mobility and its ability to infect humans. This research examines how various naturally occurring groundwater chemistries containing organic compounds and monovalent and divalent salt solutions will alter the fate and transport of T. gondii. Solutions containing various concentrations of humic acid, fulvic …


Structural, Charge Transport, Gas Sensing, Magnetic, Pseudocapacitive, And Electrocatalytic Properties Of Perovskite Oxides., Surendra Bahadur Karki 2022 University of Louisville

Structural, Charge Transport, Gas Sensing, Magnetic, Pseudocapacitive, And Electrocatalytic Properties Of Perovskite Oxides., Surendra Bahadur Karki

Electronic Theses and Dissertations

Perovskites are functional materials with the general formula ABO3 (A = alkali, alkaline earth or lanthanoid cations and B = transition metal or main group cations). These materials are marked by a variety of crystal structures and interesting properties such as colossal magnetoresistance, ferroelectricity, multiferroicity, superconductivity, pseudocapacitance, gas sensing, charge transport, and electrocatalytic properties. The formula of perovskite can be written as AA’BB’O6, when there is ordering between two cations over A and B-sites. Such compounds are called double perovskite oxides. Some amount of oxygen could be lost from crystal structure without decomposition of the phase. Such …


Development & Validation Of A Piv System For Obtaining Data From A Uasb Reactor, Camila D' Bastiani, Gerald Gallagher, David Kennedy, Anthony Reynolds 2022 Technological University Dublin

Development & Validation Of A Piv System For Obtaining Data From A Uasb Reactor, Camila D' Bastiani, Gerald Gallagher, David Kennedy, Anthony Reynolds

Conference Papers

Anaerobic digestion processes can generate energy in the form of biogas while treating organic wastewater. The efficiency of the treatment, and thus the generation of biogas, is closely linked to the type and design of the reactor, and the technology used. Granular anaerobic digestion technology offers advantages such as a higher loading rate and reduction of the space needed. However, the hydrodynamics inside this type of reactor can be complex due to the presence of solids (granules) and gas (biogas) phases along with the liquid phase (wastewater). This is one of the reasons why the study and optimization of reactors …


Tuning Electrochemical Interactions And Polymer Electrolyte Interfaces For Enhanced Organic Acid Separations Using Electrodeionization, Matthew Leo Jordan 2022 Louisiana State University and Agricultural and Mechanical College

Tuning Electrochemical Interactions And Polymer Electrolyte Interfaces For Enhanced Organic Acid Separations Using Electrodeionization, Matthew Leo Jordan

LSU Doctoral Dissertations

Chemical separations are critical processes for chemical and industrial plants to purify and isolate products however current separation technologies, such as distillation, rely on energy intensive processes. Electrochemical separation processes, such as electrodialysis and electrodeionization, are an energy efficient alternative that are emerging as an alternative for thermal-based separations. Organic acids are weakly ionizable species and susceptible for purification from process streams using electrochemical processes. Recently the fermentation route has garnered greater attention as a means for producing value-added chemicals, such as organic acids, from a renewable feedstock and aiding the circular economy. Some of the challenges electrodialysis faces for …


Development Of Advanced Models For Pre-Ignition Prediction In Gas Engines And Analytical Model For Wallfilm Evaporation, Ankith Ullal 2022 Michigan Technological University

Development Of Advanced Models For Pre-Ignition Prediction In Gas Engines And Analytical Model For Wallfilm Evaporation, Ankith Ullal

Dissertations, Master's Theses and Master's Reports

Ever-changing regulations aimed at improving efficiency and reducing harmful emissions have resulted in many power-generation device (engine) manufacturers to adopt new strategies. Computer simulation of these new strategies of power generation requires more accurate and higher fidelity modelling tools. In the present study, two such models are developed. The first model deals with pre-ignition phenomena driven by lubricant (lube) oil in natural gas engines and the second model is relevant to prediction of wallfilm evaporation by employing analytical solutions to transport governing equations for boundary layers.

Pre-ignition in engines has been the subject of current research with the advent of …


Design And Analysis Of Marangoni-Driven Robotic Surfers, Mitchel L. Timm 2022 Michigan Technological University

Design And Analysis Of Marangoni-Driven Robotic Surfers, Mitchel L. Timm

Dissertations, Master's Theses and Master's Reports

We designed and experimentally studied the dynamics of two robotic systems that surf along the water-air interface. The robots were self-propelled by means of creating and maintaining a surface tension gradient resulting from an asymmetric release of isopropyl alcohol (IPA). The imbalance in the distribution of surface tension surrounding the robots generates a propulsive force commonly referred to as Marangoni propulsion. First, we considered a single surfer, which was custom-made with novel control mechanisms that allow for both forward motion and steering to be remotely adjusted solely through the manipulation of local surface stresses. We analyzed the performance of this …


Fundamentals Of Microgel Flooding And Nanoparticles-Stabilized Foams In Enhanced Oil Recovery, Shuaijun Li 2022 CUNY City College

Fundamentals Of Microgel Flooding And Nanoparticles-Stabilized Foams In Enhanced Oil Recovery, Shuaijun Li

Dissertations and Theses

For centuries oil has remained a critical energy source for human civilization. After years of extraction, many oil fields have reached or are reaching a decline stage of production, even though up to a half of the total crude oil reserves in these fields has not been recovered yet. One reason is due to the structural heterogeneity of the oil reservoirs—reservoirs may consist of regions of higher permeability with larger pore size and regions of lower permeability with smaller pore size. Displacing fluids tend to flow through large permeability zones only without reaching the oil trapped in low permeability region; …


Droplets In An Electric Field: Surface Rheology, Coalescence And Rebound, Yu Han 2022 CUNY City College

Droplets In An Electric Field: Surface Rheology, Coalescence And Rebound, Yu Han

Dissertations and Theses

Electrocoalescence is the process in which pairs of conducting droplets suspended in a continuous dielectric (nonconducting) liquid phase are drawn together and merge upon the application of an electric field. The electric field polarizes each of the droplets in the field direction. The polarization causes the drops to deform and drives a dipolar attraction which forces them to approach each other and coalesce. Many technologies use electric fields to manipulate fluid dispersions. Electrocoalescence is an essential unit operation for separating water droplets in a crude oil. This water in oil emulsion is stabilized by surfactants, such as asphaltenes, resins and …


Design And Control Of Intensified Membrane Reactor Systems Through Module-Based Design Approach, Brent Bishop 2022 West Virginia University

Design And Control Of Intensified Membrane Reactor Systems Through Module-Based Design Approach, Brent Bishop

Graduate Theses, Dissertations, and Problem Reports

As interest in the modularization and intensification of chemical processes continues to grow, more research must be directed towards the modeling and analysis of intensified process units. Intensified process units such as membrane reactors pose unique challenges pertaining to design and operation that have not been fully addressed in the reported literature. This work aims to address the design and control challenges caused by the integration of phenomena and the loss of degrees of freedom (DOF) that occur in the intensification of modular membrane reactor units.

First, a novel first-principles approach for modeling membrane reactors is developed using the AVEVA …


Advanced Process Modeling And Optimization Of Amine-Based Carbon Capture Process, Paul Jide Terhemba Akula 2022 West Virginia University

Advanced Process Modeling And Optimization Of Amine-Based Carbon Capture Process, Paul Jide Terhemba Akula

Graduate Theses, Dissertations, and Problem Reports

With the rise of carbondioxide (CO2) concentration in the atmosphere to more than 400 parts per million (ppm), research efforts have been focused on achieving net-zero carbon emission technologies. Post-combustion CO2 capture (PCC) is a key strategy in reducing CO2 emissions. Amine-based CO2 capture is the baseline technology for retrofitting existing power stations. However, the integration of amine-based PCC technology with power plants to reduce greenhouse gas emissions incurs a high energy penalty, decreasing a powerplant’s efficiency by about 23 percentage points. Understanding the capture plant dynamics plays an important role in its technical and economic performance. Rigorous models are …


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