Digital Commons Network^™

Density Functional Theory Study Of Some Important Biological Molecules, Desmond Khan

Theses and Dissertations

This study examines the performance of various quantum chemical methods, particularly density functional theory (DFT), in predicting noncovalent interactions in eleven unnatural amino acids. The research compares five DFT functionals (PBE-D3, B3LYP-D3, HSE06, M06-2X, and ꞷB97XD) and MP2 theory against the benchmark CCSD(T) method, using two Pople basis sets (6-31G* and 6-311++G**). Results highlight ꞷB97XD's superior performance in capturing strong dispersion interactions, especially when paired with the 6-311++G** basis set. Additionally, the study investigates interactions between biomimetic Fe and Mg co-doped montmorillonite clay and the amino acids. It reveals the necessity of employing PBE-GGA + U with U ≥ 4 …

Encompassing ‘Himdag’ (Indigenous Way Of Life) To Address Cardiometabolic Disease In American Indian And Alaska Native Communities Through Research, Policy And Action, Heather Medicine Bear

Theses and Dissertations

Cardiometabolic diseases (CMD), encompassing conditions such as cardiovascular disease, diabetes, kidney disease and non-alcoholic fatty liver disease, present a significant health burden within American Indian and Alaska Native (AI/AN) communities. This dissertation, through the culmination of three products, including a scoping review, policy brief and strategic planning toolkit, seeks to understand and address CMD in tribal communities through an Indigenous lens. Product #1, Interventions for Cardiometabolic Health in American Indian and Alaska Native Communities: A Scoping Review, entails a thorough review of implemented CMD interventions targeting AI/AN communities to understand programmatic, clinical, and community-based prevention strategies. By synthesizing available evidence, …

Mcmi-Iv And Pid-5 Antecedents To Self-Reported Sexual Perpetration, Katya Maureen Mickelson

Theses and Dissertations

Sexual perpetration is a pervasive public health concern with various theoretical models used to account for the developmental trajectory of this form of behavior. Personality traits have been incorporated into both etiologic and violence risk assessment predictive models. Contemporary personality inventories have not been examined extensively as risk indicators of self-reported sexual aggressiveness. The current study examined links between self-reported sexual perpetration and selected scales from the Millon® Clinical Multiaxial Inventory (MCMI®-IV) and Personality Inventory for DSM-5 (PID-5). Data from an initial pool of respondents (N = 1,408) was segregated after protocol interpretability exclusions into men who self-reported past sexual …

Co2-Storage Trapping In Deep Saline Aquifers: Numerical Modeling On The Broom Creek Formation, Christopher Nkansah

Theses and Dissertations

Carbon dioxide (CO2) storage in deep saline aquifers holds promise as a viable solution to mitigate greenhouse gas (GHG) emissions. Bulk-CO2 injection and sequestration in deep saline aquifers is a complex geological process. Previous studies have shown that bulk-CO2 injection into deep saline aquifers provides sufficient aquifer storage efficiency. In North Dakota, the Broom Creek Formation exists in the subsurface as the upper unit of the Minnelusa Group.This study presents a simulation study of bulk-CO2 injection and storage in a saline aquifer belonging to the Minnelusa Group in the Broom Creek Formation by providing insights into and evaluating the efficiency …

Christianity In Conversations About Sexuality: Influences Of Parental Communication On Young Women’S Navigation Of Nonconsensual Sexual Experiences, Danielle Piggott

Theses and Dissertations

Women are forced to cope with the reality of sexual violence in multiple ways throughout their young adult life. This study sought to understand the influence of parental messaging on how young women understand consent and their own vulnerability to sexual assault, how they respond to friends who disclose to them about experiencing sexual assault, and how they personally conceptualize and recover from sexual assault. A sample of 384 college-aged women completed an online survey with questionnaires about messages from and relationships with their parents, beliefs about sex and sexual assault, sexual history, and mental health related symptoms. Regression analyses …

The Healing Of Stories: International Teachers’ Lived Experiences Of School Culture Using The Hourglass Model For Mindful Reflections, Vesna Radivojevic

Theses and Dissertations

School culture affects all facets of teaching and learning. Starting from individual international teachers’ perspectives and their accounts relating to school culture, new insights and perspectives on the problem of practice were gained. The research focused on answering the questions: What are teachers’ experiences of school culture in international schools? What are teachers’ perspectives on critical components in developing a positive school culture? What was helpful to teachers when experiencing the positive and negative aspects of a school culture? A qualitative narrative research methodology involved interviewing ten international teachers who taught in K-12 grade schools in Australia, Asia, the Middle …

Development Of A Comprehensive Ice-Phobicity Test Stand (Cipts) For Understanding The Fundamentals Of Ice Nucleation And Adhesion, Derrick Charles Seubert

Theses and Dissertations

From the formation of ice on the leading edges of aircraft and their wings, wind turbine blades, and even roadways and powerlines, it is clear that modern infrastructure suffers from ice formation and adhesion. Due to this fact the development of materials and surfaces to mitigate the effects of icing have gained much attention in recent years. While there are many different anti-icing and deicing techniques, the development of intrinsically ice-phobic materials and material surfaces shows the most promise as a passive anti-icing method. In this work an accurate Comprehensive Ice-Phobicity Test Stand (CIPTS) has been created to test two …

On The Design Of Novel Bioplastics-Based Materials Using Advanced Blend Design And Solvent Casting, Edner Oloo

Theses and Dissertations

The development of bioplastic composites holds significant importance in addressing theescalating environmental concerns associated with conventional plastic materials, also referred to as traditional plastics. Traditional plastics are derived from fossil fuels. The utilization of fossil fuels to produce these plastic materials, and at the alarming rate they are currently being produced, contributes to several issues such as climate change, resource depletion, and plastic wastes accumulation. Therefore, development of bioplastic composites has emerged as a promising solution along with recycling. Bioplastics composites offer a sustainable alternative by utilizing degradable and renewable resources such as bioplastics (plant-based polymers) or agricultural biomass wastes. …

Ads-B/Gps Integrity Identification And Evaluation Using Machine Learning Models, Anton Reider Skurdal

Theses and Dissertations

Automatic Dependent Surveillance-Broadcast (ADS-B) is part of the Federal Avi-ation Authority’s (FAA) NextGen position, navigation, and timing (PNT) system, but its packets are unauthenticated and vulnerable to attack by bad actors. This re- search aims to develop methods to detect and mitigate GPS and ADS-B risks for aircraft systems. First, a Random Forest Classifier (RFC) model was trained to clas- sify categories (erroneous, noise, dropouts) of data, achieving an accuracy of 87%. Following this, many single-stage and two-stage forecasting models were tested to forecast Navigation Integrity Category (NIC) values, with the two-stage Random For- est Regressor (RFR) achieving the lowest …

Numerical Investigation And Seismic Performance Evaluation Of Liquefied Natural Gas (Lng) Cylindrical Steel Storage Tanks Under Earthquake Loading, Shafqat Ullah

Theses and Dissertations

Cylindrical steel tanks are an important structural components of various industries, power plants, oil refineries, and other lifeline facilities. These liquid-filled reservoirs are prone to local instability (buckling) when exposed to lateral seismic forces. This thesis aims to study the seismic buckling performance of an empty and partially filled cylindrical steel storage tanks using finite element modeling (FEM) approaches. To validate the accuracy of the FEA ABAQUS software, the cylindrical tanks are considered for both static linear buckling, non-linear, as well as dynamic (seismic non-linear) analysis. A total of 3 cylindrical shells having 1 perfect model without carbon fiber reinforced …

Cold Pool Impacts On Supercell Thunderstorm Development And Updraft Characteristics, Ethan Anders Weisberger

Theses and Dissertations

Supercell thunderstorms are a mesoscale phenomenon characterized by an intense rotating updraft (i.e., the “mesocyclone”) and disproportionately account for more severe weather reports compared to ordinary deep convection. No previous research that we are aware of has explicitly analyzed the role that cold pools – shallow regions of precipitation-cooled air near the surface – play in impacting supercell development, sustenance, and strength. This thesis aims to fill in the gaps to the fundamental questions surrounding what role cold pools play (if any) in permitting a supercell to develop and maintain itself, how cold pools affect the strength and structure of …

Developing Educational Resources For Clinicians And Caregivers To Increase Use Of Aquatic-Based Therapy In Occupational Therapy, Katherine Childrey

Entry-Level Occupational Therapy Doctorate - Doctoral Capstone Symposium

Background: Aquatic therapy (AT) is a specialized intervention using the medium of water with therapeutic intent toward rehabilitation of specific physical and functional goals (Güeita-Rodríguez et al., 2019). AT benefits include increased joint mobility and muscle flexibility, improved head and neck control, increased attention and eye contact, improved tolerance of physical contact, and sensorimotor integration in the pediatric population (Kucher et al., 2015; Vonder Hulls et al., 2006). Physical therapists and occupational therapists (PT, OT) integrate AT into treatment plans supplemental to traditional practice. Occupational therapists facilitate performance patterns and directly influence children’s occupations of play, leisure, and social participation …

Assessing Even Flat-Fan Nozzles For Spot Spray Herbicide Applications, Thiago H. Vitti

Department of Agronomy and Horticulture: Dissertations, Theses, and Student Research

Herbicide efficiency in row-crop agriculture can be improved using precision technologies for controlling weeds and minimize agronomic, economic, and environmental impacts. Site-specific weed management technologies, such as spot-sprayers, allow herbicides to be sprayed only where weeds are present in the field. Understanding application parameters and their influence on weed control for site-specific spot-spray applications is essential. This research involved laboratory and greenhouse studies to investigate the coverage and coefficient of variation (CV) of even flat-fan spray nozzles under different spot-spray application scenarios, as well as the effect of weed size and application method on the control of various weed species …

Identifying Genes Linked To Variation In Metabolic And Whole Plant Phenotypes Using Data From Genome Resequencing, Transcriptomics, And Metabolic Profiling Of A Field-Grown Maize Diversity Panel, Ramesh Kanna Mathivanan

Department of Agronomy and Horticulture: Dissertations, Theses, and Student Research

Maize metabolism is highly complex and influenced by genetic variation, yet the specific genes contributing to this variation and their links to non-metabolic traits remain less understood. To address this knowledge gap, we identified genes involved in maize metabolic variation and linked them to non-metabolic traits. We utilized a quadruplicate dataset of whole genome resequencing, transcriptomic, metabolic, and whole plant phenotype data from a single common field experiment of 660 diverse maize inbred lines. Leaf samples were collected shortly before flowering and analyzed using GC-MS for 26 metabolites. A Resampling Model Inclusion Probability Genome-Wide Association Study (RMIPGWAS) of approximately 2.6 …

Understanding And Tuning Magnetism In Van Der Waals-Type Metal Thiophosphates, Rabindra Basnet, Jin Hu

Physics Faculty Publications and Presentations

Over the past two decades, significant progress in two-dimensional (2D) materials has invigorated research in condensed matter and material physics in low dimensions. While traditionally studied in three-dimensional systems, magnetism has now been extended to the 2D realm. Recent breakthroughs in 2D magnetism have attracted substantial interest from the scientific community, owing to the stable magnetic order achievable in atomically thin layers of the van der Waals (vdW)-type layered magnetic materials. These advances offer an exciting platform for investigating related phenomena in low dimensions and hold promise for spintronic applications. Consequently, vdW magnetic materials with tunable magnetism have attracted significant …

Crystal Structure Of A Tris-(2-Aminoethyl)Methane Capped Carbamoylmethylphosphine Oxide Compound, Brandon G. Wackerle, Eric J. Werner, Richard J. Staples, Shannon Biros

Open Access Publishing Support Funded Articles

The mol­ecular structure of the tripodal carbamoyl­methyl­phosphine oxide compound diethyl {[(5-[2-(di­eth­oxy­phosphor­yl)acetamido]-3-{2-[2-(di­eth­oxy­phos­phor­yl)acetamido]­eth­yl}pent­yl)carbamo­yl]meth­yl}phospho­nate, C25H52N3O12P3, features six intra­molecular hydrogen-bonding inter­actions. The phospho­nate groups have key bond lengths ranging from 1.4696 (12) to 1.4729 (12) Å (P=O), 1.5681 (11) to 1.5811 (12) Å (P—O) and 1.7881 (16) to 1.7936 (16) Å (P—C). Each amide group adopts a nearly perfect trans geometry, and the geometry around each phophorus atom resembles a slightly distorted tetra­hedron.

Cohen-Macaulay Type Of Open Neighborhood Ideals Of Unmixed Trees, Jounglag Lim

All Theses

Given a tree T and a field k, we define the open neighborhood ideal N(T) of T in k[V] to be the ideal generated by the open neighborhoods of all vertices in the graph. If T is unmixed with respect to the total domination problem, then it is known that N(T) is Cohen-Macaulay. Our goal is to compute the (Cohen-Macaulay) type of k[V]/N(T) using graph theoretical properties of T. We achieve this by using homological algebra and properties of monomial ideals. Along the way, we also provide a different characterization of unmixed trees and a generalization of the total dominating …

Fault Detection And Location In Renewable-Fed Distribution Systems Using Low Voltage Sensors, Bushra Farhat

All Theses

The penetration of Distributed Energy Resources (DERs) into the Electric Power System (EPS) is increasing. These (DERs) are mostly inverter-based resources (IBRs) that are integrated into (EPS) at the distribution level. Therefore, it has become necessary to leverage the integration of (IBRs) for both commercial and residential distribution systems through the deployment of Microgrid (MG). However, existing distribution systems that use fuses for sensing and isolating faults are not equipped to handle protection of microgrids where fault currents are fed from multiple sources and can flow downstream or upstream. Bulk of the protection schemes proposed in literature are heavily dependent …

Understanding The Challenges To Robotic-Assisted Surgery Adoption From The Perspectives Of The Human-Robot Interaction, Built Environment, And Training, Patrick A. Fuller

All Theses

Introduction: Robotic-assisted surgery (RAS) is a form of minimally invasive surgery that is increasing in both its adoption and development due to many perceived advantages such as tremor reduction and motion scaling. However, RAS is still relatively new and there are a variety of novel barriers and challenges to the adoption of these platforms. Objectives: This study aims to understand how the integration of RAS platforms impacts the interactions and outcomes of interactions between surgical team members to explore the barriers from three aspects critical to facilitating Robotic-assisted-surgery (RAS) adoption: the human-robotic interaction, built environment, and RAS training. Future …

Exploring Healthcare Chatbot Information Presentation: Applying Hierarchical Bayesian Regression And Inductive Thematic Analysis In A Mixed Methods Study, Samuel Nelson Koscelny

All Theses

High blood pressure, also known as hypertension, significantly increases the risk of heart disease and stroke, which are leading causes of death in the United States. While contributing to over 691,000 deaths in 2021 alone in the United States (U.S.), it also imposes immense economic burden on the healthcare system, costing approximately $131 billion annually. One way to address this issue is for increased self-care behaviors and medication adherence, both of which require sufficient health literacy. Despite the importance of health literacy, 90% of U.S. adults struggle with health-related subjects. Overcoming the issues associated with health literacy requires addressing the …

Factors Influencing Adventitious Root Formation Of Floral Hemp In Propagation, Alexandra Carver

All Theses

Commercial propagators have reported relatively poor propagation success, e.g., <75% rooting, for many hemp (Cannabis sativa) cultivars. These rooting percentages have a significant economic impact due to the wasted labor, space and supplies. Also, the market demands 100% of the propagation cells in a tray to be fully rooted, thus repairing and replacing poorly rooted or unrooted cuttings requires significant labor cost. The goal of this thesis was to evaluate several factors that influence adventitious root formation of hemp stem cuttings.

Chapter 2 describes an experiment conducted to identify rooting hormone treatments that could improve propagation success. Sixteen combinations of indole-3-butyric acid (IBA; 0, …

Trust: The Inertia Taxonomy Of Trust And Learning Outcomes Of Trust Building Exercises, Ann B. Lyons

All Theses

This study investigates United States construction professionals’ view of trust in the workplace. In particular the focus is on building trust through trust building exercises. In order to accomplish this, a literature review was conducted focusing on trust in the worldwide construction industry. This was followed by interviews with US construction professionals who focus on team building. These interviews informed a survey sent to a wide variety of US construction professionals. The survey had two sections of content questions, 1. view of trust indicators and 2. perception of trust building exercises. Finally, experts in the field of construction team building …

A Study Of The Impact And Mitigation Strategies For Community-Defined Historic Places At Immediate (Within Three Decades) Risk Of Sea Level Rise, Isaac Quaye

All Theses

The rising sea level casts formidable threats on community-based historic places within coastal communities. These community-defined historic places derive their meaning from local values and are more recognized within the local community. Unlike recognized iconic historic places, these resources are confronted with inadequate resources to address the impacts of punctuated climate events. This study investigates the imminent threats posed by sea level rise (SLR) to community-defined historic places within the next three decades (2025) and explores mitigation strategies proposed by stakeholders. The study used a GIS-based (enhanced bathtub model) to model the impact of coastal inundation on three historic places …

Functional Characterization Of A Lncrna Afu-254 In Stress Response And Pathogenesis Of Aspergillus Fumigatus, Ritu Devkota

All Theses

Aspergillus fumigatus is a saprophytic fungus that can cause a collection of diseases termed aspergillosis; the most severe is invasive pulmonary aspergillosis (IPA). Azole is a major class of antifungal drugs used to treat invasive pulmonary aspergillosis. However, in recent years, there has been an increase in fungal resistance to azole drugs, making the treatment of IPA even more challenging. It is becoming increasingly clear that long non-coding RNAs (lncRNAs), i.e., the RNAs that do not translate into proteins, mediated regulation is vital in stress response and pathogenesis; however, the mechanisms of how lncRNA contribute to fungal stress resistance and …

Evaluation Of Subjective And Objective Workload Of Forestry Professionals, Hasini L. M. Mapatunage

All Theses

The Southern United States accounts for about 40% of the productive timberland of the country and is known as the wood basket of the United States. Timber logging is an important contributor to South Carolina’s economy. Feller-buncher, skidder and loader operators play a vital role in the timber industry of South Carolina. However, their job is far from easy, especially as there are only a few members of a logging crew. They have to operate complex heavy machinery in challenging terrains while ensuring the efficient harvesting of timber, which demands extraordinary skills, precision, and better decision-making, leading to excessive mental …

Influence Of Row Pattern And Prohexadione Calcium On Peanut (Arachis Hypogaea L.) Maturity And Profitability, Samantha N. Mehl

All Theses

Many newer peanut cultivars offer yield benefits but have larger canopies and are taking 10 or more days longer to reach desired maturity levels. Prohexadione calcium (PC) and twin row planting pattern have been reported to increase the amount of orange, brown or black pods compared to their respective alternatives. Four cultivars were selected and studied based on frequency of use in South Carolina then paired into an earlier maturing group that reached optimal maturity at 135 to 140 days after planting, and a later maturing group that reached optimal maturity at 150 or more days after planting.

Twin row …

Predicting The Ductility Of Tungsten Based Bcc Refractory High Entropy Alloys: A Computational Science Driven Study, Akshay Korpe

All Theses

Bcc refractory high entropy alloys (HEAs) are a relatively new category of metallic alloys that promise excellent irradiation resistance and strength retention at high temperatures but exhibit brittle behavior at room temperatures limiting their formability. Understanding the deformation mechanisms and predicting their ductility at room temperature is a topic of interest in contemporary research.

In this work, multiple independent ductility criteria for quantifying the ductility of these HEAs were studied, calculated and compared using Density Functional Theory (DFT) calculations and continuum mechanics frameworks. These ductility parameters were calculated for various W-Ta-Cr-V alloys and the trends were analyzed for each criteria …

Developing An Assessment Tool For Ideation Effectiveness: A Survey-Based Approach For The Shah’S Method Of Design Space Exploration, Venkat Jaya Deep Jakka

All Theses

The research is focused on creativity in engineering design. The goal is to understand if creativity in engineering design can be assessed using a less resource-intensive approach, specifically a survey, compared to design exercises. The survey builds on the metrics established by Shah and colleagues. The four metrics are Novelty, Quality, Variety and Quantity. The metrics are measured with the help of a design activity that is deployed to the participants. These metrics have been used in comparative analysis to assess treatments such as new design methods and personality types. However, the downside of the metrics is that they require …

Interactions Between High-Pressure Processing And Natural Antimicrobials In Ground White-Meat Chicken: An Analysis Of Microbial, Textural Charactheristics And Physicochemical Changes, Amalia M. Diaz Alejandro

All Theses

High Pressure processing is an innovative technique for preserving a wide variety of foods, including meat, and this method is increasingly used to satisfy consumer demand for quality food products. High-pressure treatment can impact, negatively or positively, various aspects of meat quality, including color, texture, protein denaturation, and microbial stability, particularly when food products are processed at ambient or low temperatures. By minimizing thermal exposure, appropriate high-pressure ranges help to prevent quality and nutrition degradation, reduce microbial contamination, and enhance tenderness.

The first objective of this research was to examine the influence of high-pressure processing and addition of natural antimicrobials …

Disease Ecology Of The Caribbean Spiny Lobster Panulirus Argus: The Effect Of A Nemertean Egg Predator, Carcinonemertes Conanobrieni, On The Host's Reproductive Performance And Active Parental Care, Natalie C. Stephens

All Theses

Anthropogenic stressors and climate change are contributing to the rapid deterioration of marine ecosystems and the important ecological services they provide to coastal communities; concomitantly, this allows infectious agents that cause disease to proliferate in marine environments. At the forefront of marine disease ecology are the impacts of pathogens and parasites on commercially and recreationally exploited decapod crustaceans, including the Caribbean spiny lobster Panulirus argus. While there are few pathogens and parasites known to infect P. argus, emerging threats such as the nemertean micro-egg predator Carcinonemertes conanobrieni pose new, unexposed problems across its Greater Caribbean distribution. Beyond its …