Doctoral Dissertations

Permanent URI for this collection

https://hdl.handle.net/10919/11041

Browse

Now showing 1 - 20 of 17398

1,3-Disubstituted-tetrahydro-β-carbolines: A New Method for Stereochemical Assignment and Synthesis of Potential Antimalarial Agents
Cagasova, Kristyna (Virginia Tech, 2021-06-21)
Malaria is a serious mosquito-borne disease affecting the majority of Earth's southern hemisphere. While consistent efforts to curb malaria spread throughout 20th and early 21st century were largely successful, the recent rise in resistance to antimalarial treatments resulted in an increasing incidence rate and stalling mortality rate. This trend clearly signifies the need for the development of novel antimalarial agents able to circumvent current drug-resistance mechanisms. In 2014, in collaboration with Prof. Maria Belen Cassera from the University of Georgia, our group found that compound 1a (1R,3S-MMV008138), discovered from the publicly available Malaria Box, targets an essential biosynthetic pathway (MEP pathway) of malaria-causing parasite Plasmodium falciparum. Analogs of 1a synthesized in our laboratory were found effective against multi-resistant Dd2 strain of P. falciparum which, together with an absence of MEP pathway in humans, suggests that potent analogs of 1a may be safe and efficient antimalarial drug candidates. The initial bioassay studies determined that only one of four possible MMV008138 stereoisomers satisfactorily inhibits the target PfIspD enzyme. Thus a secure determination of stereochemistry in 1a analogs was of utmost importance to the structure-activity relationship studies performed in our group. The second chapter of this work discusses the validation of the previously known empirical stereoassignment method based on analysis of relative shift of 13C NMR resonances between cis and trans diastereomers and compares it to a new method based on 3JHH coupling constants developed in our laboratory. We demonstrate that the new method relying on the analysis of 1H-1H coupling is reliable over large samples of experimental data and suitable even when only a single diastereomer is produced in the synthetic process. Importantly, the origin of 3JHH coupling constants is well understood, unlike the source of relative differences in 13C NMR shifts observed in the older method. The empirical observations for both stereoassignment methods are supported by extensive density-functional theory calculations, which validate the new 1H-1H coupling-based assignment but do not provide a conclusive explanation for the origin of the 13C NMR-based method. In the third chapter, we discuss the replacement of the carboxylic acid moiety in 1a by alternative functional groups promising improved toxicity and bioavailability profile. The total synthesis of tetrazole (trans-23a) and phosphonic acid ((±)-62a) derivatives of 1a is discussed in detail. The tetrazole analog 23a was previously synthesized in the Carlier group as a diastereomeric mixture of cis and trans isomers (dr = 3:7), and it was tested for growth inhibition of multi-resistant P. falciparum with promising results. Later, the synthesis was revisited to obtain a stereochemically pure sample of trans-23a, which was expected to show improved potency compared to the original sample. Furthermore, the synthesis of pure trans-23a confirmed the accuracy of the previous assignment of cis and trans diastereomers in the mixture. Unfortunately, neither analog showed an improvement in potency relative to 1a.
1. Tests of the coupled shock tube/mass-spectrometer technique ; 2. The pyrolysis of neopentane by atomic resonance absorption spectrophotometry
Bernfeld, Diane Lois (Virginia Polytechnic Institute and State University, 1982)
Part 1 The coupled shock-tube/mass spectrometer apparatus is characterized in terms of its capabilities for chemical kinetic studies. Criteria for doing kinetic measurements by this experimental technique are discussed. The characterization experiments showed that our apparatus was capable of giving plausible signal shapes for non-reactive dynamic shots at P₁ = 5 torr. Measurements of ion current under static conditions showed that response of the quadrupole mass spectrometer was linear over a range of P₁ = 0-5 torr. Schlieren measurements indicated that the shock wave velocity was erratic and non-reproducible over the last 5 feet of the test section and that the velocity at the endwall could not be predicted from the schlieren data. The electron beam width was found to be ~.1" and the implications of this measurement for further studies on the free jet are outlined. The present beam width is suitable for jet studies in which bulk ionization of gas from a cross-section of the jet is performed. Design improvements needed for future reactive studies on our system are reviewed. In addition, experimental studies of jet risetime with a pulsed molecular beam apparatus showed poor agreement between the experimental and theoretical jet risetimes. The apparent discrepancy is discussed and possible explanations for it are given. Part 2 The rate constant k₁ for the reaction C₅H₁₂ → C₄H₉ + CH₃ was determined from reflected shock experiments (1100-1300°K) in which the progress of reaction was monitored by the appearance of H atoms. Atomic resonance absorption spectrophotometry at the Lyman-α line was performed on three mixtures (20 ppm, 10 ppm, 5 ppm) of neopentane in argon to give k₁ = .17 x 10¹⁸ exp (-84800±6200/RT) sec⁻¹. This result is in very good agreement with earlier single pulse shock tube experiments. In addition, calibration experiments for H atom were performed by shock-heating two mixtures (10 ppm and 5 ppm) of neopentane in argon. The results obtained were in good agreement with previous calibration data.
The 1H and 13C dynamic nuclear polarization (DNP) enhancement for novel silica phase immobilized nitroxide (SPIN) samples
Gitti, Rossitza K. (Virginia Tech, 1991-12-06)
The solid/liquid intermolecular transfer (SLIT) flow dynamic nuclear polarization (DNP) experiment potentially provides new methodology for studying interfacial phenomena (e.g., weak hydrogen bonding). In addition, the high efficiency of the transfer also ensures dramatically enhanced NMR signals. These large DNP enhancements could alleviate sensitivity limitations in various flow NMR experiments. Previous studies have established that silica phase immobilized nitroxide (SPIN) radical system are advantageous in the SLIT experiment. In favorable cases (e.g. DCCI₃/SPIN system) a ¹³C DNP enhancement 60 times in excess of the high magnetic field (4.7 T) magnetization has been achieved.¹² However a number of factors still limit the SPIN system presently available. For example, low magnetogyric ratio nuclides, ¹³C, ¹⁵N, which are not dominated by scalar relaxation mechanism require high surface radical concentrations. The focal point of the present study is the preparation and characterization of several new SPIN radical systems and can be divided into two parts: 1). Preparation, EPR, and DNP Characterization of Achiral SPIN Radicals: a number of SPIN samples were prepared in order to examine the dependence of the observed SLIT DNP enhancements as a function of the surface spin concentration and also isotope-substitution of the immobilized radicals. The SPIN samples were characterized by EPR and DNP. The results show that the increase in the spin concentration does not offer any advantage for ¹H DNP studies. In contrast, ¹³C SLIT DNP results in improved SPIN sample demonstrate the possibility of monitoring dipolar dominated ¹³C DNP enhancements as a result of better leakage factors and suppressed three-spin effects at higher radical concentration. The effect of substitution of deuterons for protons in the immobilized radical also suggest an appreciable contribution of a solid-state three-spin effect. 2). Preparation, EPR, and DNP Characterization of Chiral SPIN Samples: This part of the study provides a chiral SPIN radical suitable for monitoring enantioselective ¹³C DNP enhancements. The DNP results suggest that selective enantiomer/chiral SPIN interactions are feasible. Specifically, differences in the ¹³C DNP enhancements for a model system: (R)- and (S)- enantiomers of bromocamphor, and a (R) chiral SPIN sample were observed.
3-D Bio-inspired Microenvironments for In Vitro Cell Migration
Hosseini, Seyed Yahya (Virginia Tech, 2015-10-21)
Cancer metastasis is the leading cause of death related to cancer diseases. Once the cancer cells depart the primary tumor site and enter the blood circulation, they spread through the body and will likely initiate a new tumor site. Therefore, understanding the cell migration and stopping the spread in the initial stage is the utmost of importance. In this dissertation, we have proposed a 3-D microenvironment that (partially) mimics the structures, complexity and circulation of human organs for cell migration studies. We have developed the tools to fabricate 3-D complex geometries in PDMS from our previously developed single-mask, single-etch technology in silicon. In this work, 3-D patterns are transferred from silicon structures to glass following anodic bonding and high temperature glass re-flow processes. Silicon is etched back thoroughly via wet etching and the glass is used as master device to create 3-D PDMS structures for use in dielectrophoresis cell sorting applications. Furthermore, this work has been modified to fabricate 3-D master devices in PDMS to create 3-D structures in collagen hydrogels to mimic native tissue structures. We have studied the interaction of endothelial cells with model geometries of blood vessels in collagen hydrogel at different concentrations to mimic the biomechanical properties of tissues varying from normal to tumor under the growth factor stimulation. Finally, we have designed and fabricated a silicon-based transmigration well with a 30um-thick membrane and 8um pores. This platform includes a deep microfluidic channel on the back-side sealed with a glass wafer. The migratory behavior of highly metastatic breast cancer cells, MDA-MB-231, is tested under different drug treatment conditions. This versatile platform will enable the application of more complex fluidic circulation profile, enhanced integration with other technologies, and running multiple assays simultaneously.
A 3-Dimensional Computer Simulation Model for Temperature Distribution Prediction in a Seafood Shipping Container
Tansakul, Ampawan (Virginia Tech, 1996)
Seafood transportation/distribution has become an important activity in the seafood industry due to increasing global demand for fresh seafood. Providing good quality seafood to consumers requires appropriate handling and packaging technology. The purpose of this research is to study the effect of various combinations of insulation and coolant quantities on temperature distribution within a seafood shipping container and packaging cost. A three-dimensional transient heat transfer model was developed to predict the temperature distribution in a fish shipping container. The finite element method was used to develop the model. An eight-noded isoparametric hexahedron element was selected. The geometric configuration of the fish shipping container and the physical and thermal properties of the materials used for packaging were the input parameters of the model. The model validation was performed in two stages to ensure component-wise validation. The first stage was for the case with no ice. The second stage was for the case with ice. The results from the model were compared to those obtained through experiments. Predicted and observed temperatures showed good agreement. The temperature predictions were within 2 °C for the case with no ice and 3 °C for the case with ice. The effect of a polyethylene/aluminum foil laminated bag on the temperature distribution in the shipping container was studied for the case with no ice. The temperatures of high density polyethylene, which simulated fish, were reduced by approximately 3 °C (maximum) due to the low emissivity of aluminum foil. The model was applied to study the effect of various combinations of insulation and coolant quantities on the temperature distribution and the packaging cost. It was found that the fish container with 1.70 cm thick polystyrene and 10 kg of ice can be used for a required shipping time of 24 hours whereas the fish container with 2.54 cm thick polystyrene and 10 kg of ice can be used for a required shipping time of 48 hours under the simulated transport conditions used in this study.
3D Coiling at the Protrusion Tip: New Perspectives on How Cancer Cells Sense Their Fibrous Surroundings
Mukherjee, Apratim (Virginia Tech, 2021-05-24)
Cancer metastasis, the spread of cancer from the primary site to distant regions in the body, is the major cause of cancer mortality, accounting for almost 90% of cancer related deaths. During metastasis, cancer cells from the primary tumor initially probe the surrounding fibrous tumor microenvironment (TME) prior to detaching and subsequently migrating towards the blood vessels for further dissemination. It has widely been acknowledged that the biophysical cues provided by the fibrous TME greatly facilitate the metastatic cascade. Consequently, there has been a tremendous wealth of work devoted towards elucidating different modes of cancer cell migration. However, our knowledge of how cancer cells at the primary tumor site initially sense their fibrous surroundings prior to making the decision to detach and migrate remains in infancy. In part, this is due to the lack of a fibrous in vitro platform that allows for precise, repeatable manipulation of fiber characteristics. In this study, we use the non-electrospinning, Spinneret based Tunable Engineered Parameters (STEP) technique to manufacture suspended nanofiber networks with exquisite control on fiber dimensions and network architecture and use these networks to investigate how single cancer cells biophysically sense fibers mimicking in vivo dimensions. Using high spatiotemporal resolution imaging (63x magnification/1-second imaging interval), we report for the first time, that cancer cells sense individual fibers by coiling (i.e. wrapping around the fiber axis) at the tip of a cell protrusion. We find that coiling dynamics are mediated by both the fiber curvature and the metastatic capacity of the cancer cells with less aggressive cancer cells showing diminished coiling. Based on these results, we explore the possibility of using coiling in conjunction with other key biophysical metrics such as cell migration dynamics and forces exerted in the development of a genetic marker independent, biophysical predictive tool for disease progression. Finally, we identify the membrane curvature sensing Insulin Receptor tyrosine kinase Substrate protein of 53 kDa (IRSp53) as a key regulator of protrusive activity with IRSp53 knockout (KO) cells exhibiting significantly slower protrusion dynamics and diminished coil width compared to their wild-type (WT) counterparts. We demonstrate that the hindered protrusive activity ultimately translates to impaired contractility, alteration in the nucleus shape and slower migration dynamics, thus highlighting the unique role of IRSp53 as a signal transducer – linking the protrusive activity at the cell membrane to changes in cytoskeletal contractility. Overall, these findings offer novel perspectives to our understanding of how cancer cells biophysically sense their fibrous surroundings. The results from this study could ultimately pave the way for elucidating the precise fiber configurations that either facilitate or hinder cancer cell invasion, allowing for the development of new therapeutics in the long term that could inhibit the metastatic cascade at a relatively nascent stage and yield a more promising prognosis in the perennial fight against cancer.
3D Deep Learning for Object-Centric Geometric Perception
Li, Xiaolong (Virginia Tech, 2022-06-30)
Object-centric geometric perception aims at extracting the geometric attributes of 3D objects. These attributes include shape, pose, and motion of the target objects, which enable fine-grained object-level understanding for various tasks in graphics, computer vision, and robotics. With the growth of 3D geometry data and 3D deep learning methods, it becomes more and more likely to achieve such tasks directly using 3D input data. Among different 3D representations, a 3D point cloud is a simple, common, and memory-efficient representation that could be directly retrieved from multi-view images, depth scans, or LiDAR range images. Different challenges exist in achieving object-centric geometric perception, such as achieving a fine-grained geometric understanding of common articulated objects with multiple rigid parts, learning disentangled shape and pose representations with fewer labels, or tackling dynamic and sequential geometric input in an end-to-end fashion. Here we identify and solve these challenges from a 3D deep learning perspective by designing effective and generalizable 3D representations, architectures, and pipelines. We propose the first deep pose estimation for common articulated objects by designing a novel hierarchical invariant representation. To push the boundary of 6D pose estimation for common rigid objects, a simple yet effective self-supervised framework is designed to handle unlabeled partial segmented scans. We further contribute a novel 4D convolutional neural network called PointMotionNet to learn spatio-temporal features for 3D point cloud sequences. All these works advance the domain of object-centric geometric perception from a unique 3D deep learning perspective.
3D Massive MIMO and Artificial Intelligence for Next Generation Wireless Networks
Shafin, Rubayet (Virginia Tech, 2020-04-13)
3-dimensional (3D) massive multiple-input-multiple-output (MIMO)/full dimensional (FD) MIMO and application of artificial intelligence are two main driving forces for next generation wireless systems. This dissertation focuses on aspects of channel estimation and precoding for 3D massive MIMO systems and application of deep reinforcement learning (DRL) for MIMO broadcast beam synthesis. To be specific, downlink (DL) precoding and power allocation strategies are identified for a time-division-duplex (TDD) multi-cell multi-user massive FD-MIMO network. Utilizing channel reciprocity, DL channel state information (CSI) feedback is eliminated and the DL multi-user MIMO precoding is linked to the uplink (UL) direction of arrival (DoA) estimation through estimation of signal parameters via rotational invariance technique (ESPRIT). Assuming non-orthogonal/non-ideal spreading sequences of the UL pilots, the performance of the UL DoA estimation is analytically characterized and the characterized DoA estimation error is incorporated into the corresponding DL precoding and power allocation strategy. Simulation results verify the accuracy of our analytical characterization of the DoA estimation and demonstrate that the introduced multi-user MIMO precoding and power allocation strategy outperforms existing zero-forcing based massive MIMO strategies. In 3D massive MIMO systems, especially in TDD mode, a base station (BS) relies on the uplink sounding signals from mobile stations to obtain the spatial information for downlink MIMO processing. Accordingly, multi-dimensional parameter estimation of MIMO channel becomes crucial for such systems to realize the predicted capacity gains. In this work, we also study the joint estimation of elevation and azimuth angles as well as the delay parameters for 3D massive MIMO orthogonal frequency division multiplexing (OFDM) systems under a parametric channel modeling. We introduce a matrix-based joint parameter estimation method, and analytically characterize its performance for massive MIMO OFDM systems. Results show that antenna array configuration at the BS plays a critical role in determining the underlying channel estimation performance, and the characterized MSEs match well with the simulated ones. Also, the joint parametric channel estimation outperforms the MMSEbased channel estimation in terms of the correlation between the estimated channel and the real channel. Beamforming in MIMO systems is one of the key technologies for modern wireless communication. Creating wide common beams are essential for enhancing the coverage of cellular network and for improving the broadcast operation for control signals. However, in order to maximize the coverage, patterns for broadcast beams need to be adapted based on the users' movement over time. In this dissertation, we present a MIMO broadcast beam optimization framework using deep reinforcement learning. Our proposed solution can autonomously and dynamically adapt the MIMO broadcast beam parameters based on user' distribution in the network. Extensive simulation results show that the introduced algorithm can achieve the optimal coverage, and converge to the oracle solution for both single cell and multiple cell environment and for both periodic and Markov mobility patterns.
3D Micromachined Passive Components and Active Circuit Integration for Millimeter-wave Radar Applications
Oliver, John Marcus (Virginia Tech, 2012-02-20)
The development of millimeter-wave (30-300 GHz) sensors and communications systems has a long history of interest, spanning back almost six decades. In particular, mm-wave radars have applications as automotive radars, in remote atmospheric sensing applications, as landing radars for air and spacecraft, and for high precision imaging applications. Mm-wave radar systems have high angular accuracy and range resolution, and, while susceptible to atmospheric attenuation, are less susceptible to optically opaque conditions, such as smoke or dust. This dissertation document will present the initial steps towards a new approach to the creation of a mm-wave radar system at 94 GHz. Specifically, this dissertation presents the design, fabrication and testing of various components of a highly integrated mm-wave a 94 Ghz monopulse radar transmitter/receiver. Several architectural approaches are considered, including passive and active implementations of RF monopulse comparator networks. These architectures are enabled by a high-performance three-dimensional rectangular coaxial microwave transmission line technology known as PolyStrataTM as well as silicon-based IC technologies. A number of specific components are examined in detail, including: a 2x2 PolyStrata antenna array, a passive monopulse comparator network, a 94 GHz SiGe two-port active comparator MMIC, a 24 GHz RF-CMOS 4-port active monopulse comparator IC, and a series of V- and W-band corporate combining structures for use in transmitter power combining applications. The 94 GHz cavity-backed antennas based on a rectangular coaxial feeding network have been designed, fabricated, and tested. 13 dB gain for a 2 x 2 array, as well as antenna patterns are reported. In an eï¬€ort to facilitate high-accuracy measurement of the antenna array, an E-probe transition to waveguide and PolyStrata diode detectors were also designed and fabricated. AW-band rectangular coaxial passive monopulse comparator with integrated antenna array and diode detectors have also been presented. Measured monopulse nulls of 31.4 dB in the ΔAZ plane have been demonstrated. 94-GHz SiGe active monopulse comparator IC and 24 GHz RF-CMOS active monopulse comparator RFIC designs are presented, including detailed simulations of monopulse nulls and performance over frequency. Simulations of the W-band SiGe active monopulse comparator IC indicate potential for wideband operation, with 30 dB monopulse nulls from 75-105 GHz. For the 24-GHz active monopulse comparator IC, simulated monopulse nulls of 71 dB and 68 dB were reported for the azimuthal and elevational sweeps. Measurements of these ICs were unsuccessful due to layout errors and incomplete accounting for parasitics. Simulated results from a series of rectangular coaxial power corporate power combining structures have been presented, and their relative merits discussed. These designs include 2-1 and 4-1 reactive, Wilkinson, and Gysel combiners at V- and W-band. Measured back-to-back results from Gysel combiners at 60 GHz included insertion loss of 0.13 dB per division for a 2-1 combination, and an insertion loss of 0.3 dB and 0.14 dB for "planar" and "direct" 4-1 combinations, respectively. At 94 GHz, a measured insertion loss of 0.1 dB per division has been presented for a 2-1 Gysel combination, using a back-to-back structure. Preliminary designs for a solid-state power amplifier (SSPA) structure have also been presented. Finally, two conceptual monopulse transceivers will be presented, as a vehicle for integrating the various components demonstrated in this dissertation.
48V/1V Voltage Regulator for High-Performance Microprocessors
Lou, Xin (Virginia Tech, 2024-06-07)
The data center serves as the hardware foundation for artificial intelligence (AI) and cloud computing, constituting a global market that has surpassed $200 billion and is experiencing rapid growth. It is estimated that data centers contribute to 1.7-2.2% of the world's electricity generation. Conversely, up to 80% of the long-term operational expenditure of data centers is allocated to electricity consumption. Consequently, enhancing the efficiency of electric energy conversion in data centers is not only economically advantageous but also crucial for achieving carbon-neutral objectives. Through collaborative efforts between the industrial and academic sectors, substantial advancements have been achieved in the energy conversion efficiency of data centers. Most converters within the data center power architecture now boast efficiencies exceeding 99%. However, the bottleneck for further improvements in system efficiency lies in the voltage regulator modules (VRMs), which grapple with challenges such as high conversion ratios, elevated output currents, and substantial load transients. These challenges are particularly pronounced for AI processors and graphics processing units (GPUs), given their heightened power demands compared to conventional central processing units (CPUs). To enhance system efficiency, a revolutionary shift in power architecture has been introduced, advocating for the adoption of a 48 V data center power architecture to replace the conventional 12 V architecture. The higher 48 V bus voltage significantly reduces distribution loss on the bus. However, the primary challenge lies in managing high step-down voltage conversion while maintaining high efficiency. Additionally, high-performance microprocessors, including CPUs, GPUs, application-specific integrated circuits (ASICs), and field-programmable gate arrays (FPGAs), require hundreds of amperes of current at low voltage levels (e.g., GPUs need >220 A at <1.85 V, CPUs need >1000 A at <1.0 V). An unavoidable consequence of upscaling processor current and size is the substantial resistive loss in VRMs. This is because such loss scales with the square of the current [I2R], and the power path area (and resistance R) expands with the processor size. The Power Delivery Network (PDN) resistance in the "last inch" of the power delivery path is becoming a limiting factor in processor performance and system efficiency. The key to reducing the I2R loss is minimizing the distance between the VRMs and processors by utilizing ultra-high power density VRMs. Furthermore, the design of Voltage Regulator Modules (VRMs) for high-performance microprocessors encounters additional formidable challenges, especially when dealing with the requirements of contemporary computing architectures. The key hurdles encompass achieving high efficiency, handling low output voltage, accommodating wide voltage ranges, managing elevated output currents, and addressing significant load transients. These challenges prompt both academia and industry to explore novel topologies, innovative magnetic integration methods, and advanced control strategies. The prevailing trend in state-of-the-art 48V solutions centers around the adoption of two-stage configurations, wherein the second stage can leverage conventional 12V solutions. However, this approach imposes limitations on power density and efficiency, given that power traverses two cascaded DC/DC converters. Additionally, the footprint of decoupling capacitors and I2R loss on the intermedia bus between the two stages is emerging as a noteworthy consideration in designs. In response to these challenges, a novel proposition introduces a single-stage 48V coupled-transformer voltage regulator (CTVR) tailored for high-performance microprocessors. This innovative design aims to deliver ultra-high power density and superior efficiency. The converter employs a unique magnetic structure that integrates transformers and coupled inductors from multiple current-doubler rectifiers. Significantly, by utilizing the magnetizing inductors of transformers as output inductors, there is a substantial reduction in the size of magnetic components. Various implementations are explored, each addressing specific design objectives. Initially, a single-stage coupled-transformer voltage regulator (CTVR) with discrete magnetics is presented, offering a 48V solution while maintaining a comparable size and cost to a state-of-the-art 12V multiphase buck regulator. Leveraging the indirect-coupling concept, magnetic components are standardized, enabling scalability and facilitating multiphase operation. A prototype is constructed and tested to validate the CTVR's performance. With a 48V input and 1.8V output, the peak efficiency registers at 92.1%, and the power area density is 0.45 W/mm2. However, voltage ringing is observed in both primary and secondary switches due to a larger leakage inductance and hard-switching operation. Subsequently, a transition to soft-switching operation is implemented to address the voltage ringing issue. The leakage inductance is intentionally designed to supply energy for zero-voltage switching (ZVS) of primary switches, turning the previously perceived drawback into an opportunity for efficiency improvement. As a result, testing demonstrates a peak efficiency increase of more than 1%, reaching 93.6%. Furthermore, efforts are made to enhance small leakage inductance by employing well-interleaved printed circuit board (PCB) windings. Following a series of design optimizations, the prototype achieves a peak efficiency of 93.1% and a remarkable power density of 1037 W/in3, accounting for gate driver loss and size. Despite an increase in cost associated with PCB windings, this proposed solution attains the highest power density and stands as the pioneering 48V single-stage design surpassing 1000 W/in3 power density. When prioritizing efficiency in the design, the quasi-parallel Sigma converter emerges as another optimal choices for a 48V solution. However, the intricate and distinctive quasi-parallel structure of the Sigma converter necessitates a thorough examination of its control mechanism, particularly in light of the rapid load transient response requirements. To address this, an adaptive voltage positioning (AVP) design for the Sigma converter is introduced, employing enhanced V2 control. Guidelines and limitations are provided to stabilize the converter and enhance its overall performance. Ultimately, the AVP function and load transient performance are substantiated through simulation and experimental results.
4D combustion and flow diagnostics based on tomographic chemiluminescence (TC) and volumetric laser-induced fluorescence (VLIF)
Wu, Yue (Virginia Tech, 2016-12-02)
Optical diagnostics have become indispensable tools for the study of turbulent flows and flames. However, optical diagnostics developed in the past have been primarily limited to measurements at a point, along a line, or across a two-dimensional (2D) plane; while turbulent flows and flames are inherently four-dimensional (three-dimensional in space and transient in time). As a result, diagnostic techniques which can provide 4D measurement have been long desired. The purpose of this dissertation is to investigate two of such 4D diagnostics both for the fundamental study of turbulent flow and combustion processes and also for the applied research of practical devices. These two diagnostics are respectively code named tomographic chemiluminescence (TC) and volumetric laser induced fluorescence (VLIF). For the TC technique, the emission of light as the result of combustion (i.e. chemiluminescence) is firstly recorded by multiple cameras placed at different orientations. A numerical algorithm is then applied on the data recorded to reconstruct the 4D flame structure. For the VLIF technique, a laser is used to excite a specific species in the flow or flame. The excited species then de-excite to emit light at a wavelength longer than the laser wavelength. The emitted light is then captured by optical sensors and again, the numerical algorithm is applied to reconstruct the flow or flame structure. This dissertation describes the numerical and experimental validation of these two techniques, and explores their capabilities and limitations. It is expected that the results obtained in this dissertation lay the groundwork for further development and expanded application of 4D diagnostics for the study of turbulent flows and combustion processes.
6.78MHz Omnidirectional Wireless Power Transfer System for Portable Devices Application
Feng, Junjie (Virginia Tech, 2021-01-11)
Wireless power transfer (WPT) with loosely coupled coils is a promising solution to deliver power to a battery in a variety of applications. Due to its convenience, wireless power transfer technology has become popular in consumer electronics. Thus far, the majority of the coupled coils in these systems are planar structure, and the magnetic field induced by the transmitter coil is in one direction, meaning that the energy power transfer capability degrades greatly when there is some angle misalignment between the coupled coils. To improve the charging flexibility, a three–dimensional (3D) coils structure is proposed to transfer energy in different directions. With appropriate modulation current flowing through each transmitter coil, the magnetic field rotates in different directions and covers all the directions in 3D space. With omnidirectional magnetic field, the charging platform can provide energy transfer in any direction; therefore, the angle alignment between the transmitter coil and receiver coil is no longer needed. Compensation networks are normally used to improve the power transfer capability of a WPT system with loosely coupled coils. The resonant circuits, formed by the loosely coupled coils and external compensation inductors or capacitors, are crucial in the converter design. In WPT system, the coupling coefficient between the transmitting coil and the receiving coil is subject to the receiver's positioning. The variable coupling condition is a big challenge to the resonant topology selection. The detailed requirements of the resonant converter in an omnidirectional WPT system are identified as follows: 1). coupling independent resonant frequency; 2). load independent output voltage; 3). load independent transmitter coil current; 4). maximum efficiency power transfer; 5). soft switching of active devices. A LCCL-LC resonant converter is derived to satisfy all of the five requirements. In consumer electronics applications, Megahertz (MHz) WPT systems are used to improve the charging spatial freedom. 6.78 MHz is selected as the system operation in AirFuel standard, a wireless charging standard for commercial electronics. The zero voltage switching (ZVS) operation of the switching devices is essential in reducing the switching loss and the switching related electromagnetic interference (EMI) issue in a MHz system; therefore, a comprehensive evaluation of ZVS condition in an omnidirectional WPT system is performed. And a design methodology of the LCCL-LC converter to achieve ZVS operation is proposed. The big hurdle of the WPT technology is the safety issue related to human exposure of electromagnetic fields (EMF). A double layer shield structure, including a magnetic layer and a conductive layer, is proposed in a three dimensional charging setup to reduce the stray magnetic field level. A parametric analysis of the double shield structure is conducted to improve the attenuation capability of the shielding structure. In an omnidirectional WPT system, the energy can be transferred in any direction; however the receiving devices has its preferred field direction based on its positioning and orientation. To focus power transfer towards targeted loads, a smart detection algorithm for identifying the positioning and orientation of receiver devices based on the input power information is presented. The system efficiency is further improved by a maximum efficiency point tracking function. A novel power flow control with a load combination strategy to charge multiple loads simultaneously is explained. The charging speed of the omnidirectional WPT system is greatly improved with proposed power flow control.
Ab initio Calculations of Optical Rotation
Tam, Mary Christina (Virginia Tech, 2006-04-18)
Coupled cluster (CC) and density functional theory (DFT) are highly regarded as robust quantum chemical methods for accurately predicting a wide variety of properties, such as molecular structures, thermochemical data, vibrational spectra, etc., but there has been little focus on the theoretical prediction of optical rotation. This property, also referred to as circular birefringence, is inherent to all chiral molecules and occurs because such samples exhibit different refractive indices for left- and right- circularly polarized light. This thesis focuses on the theoretical prediction of this chiroptic property using CC and DFT quantum chemical models. Several small chiral systems have been studied, including (S)-methyloxirane, (R)-epichlorohydrin, (R)-methylthiirane, and the conformationally flexible molecules, (R)-3-chloro-1-butene and (R)-2-chlorobutane. All predicted results have been compared to recently published gas-phase cavity ringdown polarimetry data. When applicable, well-converged Gibbs free energy differences among confomers were determined using complete-basis-set extrapolations of CC energies in order to obtain Boltzmann-averaged specific rotations. The overall results indicate that the theoretical rotation is highly dependent on the choice of optimized geometry and basis set (diffuse functions are shown to be extremely important), and that there is a large difference between the CC and DFT predicted values, with DFT usually predicting magnitudes that are larger than those of coupled cluster theory.
Ab-normal Athletes: Technomedical Productions of Gender, Sports, Fairness, and Doping
Olson, Cora Mae (Virginia Tech, 2014-03-18)
Doping and anti-doping research laboratories are crucial sites for the production and reproduction of gender in sports. Such labs have, over time, constructed a multiplicity of gender categories through which to view and assess doping practice, but nevertheless, they consistently work hard to reproduce binary, hegemonic sex and gender categories. As part of their reproduction of the binary, I argue that technomedical researchers police gender and negotiate ethics within their research by “ab-normalizing” athletes. Ab-normalization refers to a process, adjunct to normalization, whereby gendered and racialized categories of deviance, and the means of policing such categories, are produced. Likewise, these technomedical researchers developed means of authenticating the hormonal gender of athletes. Authentication is a form of ab-normalization that represents the kind of policing that anti-doping researchers perform. It refers to the technomedical processes that produce and legitimate these hormonal gender states. In order for technomedical researchers to do this work, they have had to negotiate ethical quandaries across different spaces. Such ethical negotiations have played an important role in shaping the direction, and thus gender possibilities, within this research. Specifically, I show how technomedical researchers often shifted ethical frames while performing their research, from a sports ethical frame to either an athletic performance research ethical frame or an anti-doping research ethical frame. The first of these is premised on notions of “fair play” while the second is guided by technomedical uncertainties regarding athletic performance and doping practices. The third ethical frame reconciles these two by producing “fair play” amongst competitors through the development of technomedical detection techniques that either catch or deter cheating athletes. This shifting of ethical frames highlights how these researchers were performing legitimate scientific research at the time and not the “immoral,” ethically dubious, research as it might appear to be from our current perspective. To clarify my theoretical points on gender and ethics, I draw upon two cases. The first case deals with blood doping, which requires the withdrawal and subsequent re-infusion of blood into an athlete. The second case examines endogenous steroid use, particularly, androgenic anabolic “naturally” occurring steroids. These hormones aid in muscle production and recovery. Blood doping and endogenous steroid use are two key practices of sports doping. By deconstructing the science surrounding these two practices, I offer an alternative account of the doping debates from the more familiar accounts that explain the doping debates as a “cat and mouse game” between anti-doping researchers and athletes within which “doping” is often presented as a straightforward immoral act for the athletes. By telling the story of how these technomedical researchers simultaneously produced gender categories, ethical categories, and technomedical processes, my alternative account positions these doping debates as competing, socio-historical, articulations of “fairness” bound to competing articulations of gender. I suggest that it is possible to re-imagine “fairness” from this alternative account. Specifically, we can imagine more equitable ways to allow the individuals that do not fit neatly into the binary gender system to compete “fairly” in sports.
Abacus-Tournament Models of Hall-Littlewood Polynomials
Wills, Andrew Johan (Virginia Tech, 2016-01-08)
In this dissertation, we introduce combinatorial interpretations for three types of HallLittlewood polynomials (denoted Rλ, Pλ, and Qλ) by using weighted combinatorial objects called abacus-tournaments. We then apply these models to give combinatorial proofs of properties of Hall-Littlewood polynomials. For example, we show why various specializations of Hall-Littlewood polynomials produce the Schur symmetric polynomials, the elementary symmetric polynomials, or the t-analogue of factorials. With the abacus-tournament model, we give a bijective proof of a Pieri rule for Hall-Littlewood polynomials that gives the Pλ-expansion of the product of a Hall-Littlewood polynomial Pµ with an elementary symmetric polynomial ek. We also give a bijective proof of certain cases of a second Pieri rule that gives the Pλ-expansion of the product of a Hall-Littlewood polynomial Pµ with another Hall-Littlewood polynomial Q(r) . In general, proofs using abacus-tournaments focus on canceling abacus-tournaments and then finding weight-preserving bijections between the sets of uncanceled abacus-tournaments.
Abbeville v. the State of South Carolina: A Case Study
Weiler, Spencer C. (Virginia Tech, 2007-03-29)
Abbeville v. the State of South Carolina (2005) is the latest lawsuit in a long line of cases addressing school finance issues that originated with Brown v. the Board of Education (1954), Serrano v. Priest (1971), and the San Antonio Independent School District v. Rodriquez (1973). Unlike many of the other school finance cases that have been adjudicated, Abbeville has not been the subject of much academic scrutiny. This case study documented Abbeville's origins in an effort to begin the process of academic examination and understanding. To document the inception of this case, five research questions were developed to guide the efforts. These five research questions were: 1) What political and economic conditions were present in South Carolina in the early 1990s that led to the decision to file the lawsuit?; 2) How were the eight lead school districts selected to be a part of the plaintiffs' case?; 3) What legal arguments did both the plaintiffs and defendants use in Abbeville?; 4) Why did the state choose to contest the lawsuit?; and 5) What was the 2005 ruling in the Abbeville case and how did people closely associated with the case react to the decision? The data used to answer these research questions included analysis of primary documents and eighteen qualitative interviews. The primary documents included the state constitution, current legislation in South Carolina affecting public education, previous school finance oriented court cases in South Carolina, and student achievement data. The eighteen participants in this study all shared a high degree of familiarity with Abbeville. Eleven were directly involved in the case (testified, heard and/or made legal arguments), four were deposed, and the remaining three followed the case closely. The credibility of this study increased through the use of triangulation, or the use of multiple data sources related to an issue of uncertainty, which produced the conclusions to the study found at the end of this document. As a result of the data collected, conclusions related to Abbeville are presented along with a discussion on the implications of this study. There are also suggestions for future studies.
Aberrant hippocampal neurogenesis contributes to learning and memory deficits in a mouse model of repetitive mild traumatic brain injury
Greer, Kisha (Virginia Tech, 2019-10-02)
Adult hippocampal neurogenesis, or the process of creating new neurons in the dentate gyrus (DG) of the hippocampus, underlies learning and memory capacity. This cognitive ability is essential for humans to operate in their everyday lives, but cognitive disruption can occur in response to traumatic insult such as brain injury. Previous findings in rodent models have characterized the effect of moderate traumatic brain injury (TBI) on neurogenesis and found learning and memory shortfalls correlated with limited neurogenic capacity. While there are no substantial changes after one mild TBI, research has yet to determine if neurogenesis contributes to the worsened cognitive outcomes of repetitive mild TBI. Here, we examined the effect of neurogenesis on cognitive decline following repetitive mild TBI by utilizing AraC to limit the neurogenic capacity of the DG. Utilizing a BrdU fate-labeling strategy, we found a significant increase in the number of immature neurons that correlate learning and memory impairment. These changes were attenuated in AraC-treated animals. We further identified endothelial cell (EC)-specific EphA4 receptor as a key mediator of aberrant neurogenesis. Taken together, we conclude that increased aberrant neurogenesis contributes to learning and memory deficits after repetitive mild TBI.
The Ability of Four-Month-Olds to Discriminate Changes in Vocal Information in Multimodal Displays
McCartney, Jason (Virginia Tech, 1999-05-06)
Recent investigations into infants' intersensory perception suggest a specific developmental pattern for infants' attention to visible and auditory attributes of dynamic human faces. This work has proposed that infants' perception seems to progress along a sensory continuum: beginning with multimodal sensory cues (e.g., auditory and visual), then visual-cues alone, and finally auditory-cues alone. Additionally, research has proposed that amodal or invariant sensory information directs infants' attention to specific redundant aspects in the surrounding environment (e.g., temporal synchronicity). The current research attempted to clarify the potential methodological confounds contained in previous investigations into infant intersensory development by contrasting infant behavior within fixed trial and infant-controlled habituation procedures. Moreover, the current research examined infants' attention to auditory manipulations within multimodal displays when redundant sensory information (synchronicity) was or was not available. In Experiment 1, 4-month-old infants were habituated to complex audiovisual displays of a male or female face within an infant controlled habituation procedure, and then tested for response recovery to a change in voice. For half the infants, the change in voice maintained synchronicity with the face, and for the other half, it did not. The results showed significant response recovery (i.e., dishabituation) to the change in voice regardless of the synchronicity condition. In Experiment 2, 4-month-old infants received the same face+voice test recordings used in Experiment 1, but now within a fixed trial habituation procedure. Again, synchronicity was manipulated across groups of infants. In contrast to Experiment 1, the infants in the fixed-trial experiment failed to show evidence of voice discrimination. These results suggest that infant controlled procedures may be more sensitive to infant attention, especially in terms of complex social displays. In addition, synchronicity appeared to be unnecessary in terms of infants' ability to detect vocal differences across multimodal displays. In sum, these results highlight the importance of research methodology (e.g., infant control) and overall stimulus complexity (e.g., discrete vs. complex) involving studies of infants' intersensory development.
Abiotic and biotic factors influencing the decline of native unionid mussels in the Clinch River, Virginia
Yeager, Mary Melinda (Virginia Tech, 1994)
Declining unionid populations in the Clinch River are of concern due to the high endemism in the diverse fauna of the Cumberlandian region. Increase in agricultural and mining activities, as well as in industry and urbanization, are coupled with unionid declines throughout the watershed. In many reaches of the Clinch River, mussel populations exist which fail to show recruitment suggesting that this is the weak link in the complex life cycle. Two possible factors which could endanger the sensitive juvenile stage are the presence of sediment toxicants or adult Corbicula fluminea in the depositional areas, the preferred habitat of the juveniles. Before investigating the impacts of these factors, it was necessary to characterize the relationship of the juveniles with the sediment they inhabit. Observations of feeding behavior using videotape, dye studies in a feeding chamber, and gut content analysis were used to determine mechanisms of feeding, the primary food source, and the origin of substances taken up by juveniles. Exposure to sediment came not only through direct contact, but also through filtration of interstitial water and sediment-associated fine particulate organic matter. Juveniles used pedal locomotory and pedal sweep feeding behaviors to facilitate movement of particles into the pedal gape. Intermittent sediment toxicity was found in laboratory bioassays using Daphna magna and Chironomus riparius. These data, along with fluctuating metals in the Clinch River sediments, indicated that acute insults existed from which recovery would depend on the frequency, intensity and duration of the events. Field studies revealed that the intermittent toxicity is reflected in the community structure of benthic macroinvertebrates and impairs growth of juvenile unionids in-situ studies. The intermittent toxicity which may be associated with rain events impairs stream biota and may prevent recruitment of juvenile unionids. The presence of adult C. fluminea in sediments was found to decrease juvenile unionid growth and recovery from test sediments and to increase mortality and resuspension of juveniles into the water column. Both the presence of sediment-bound toxicants and C. fluminea may be contributing to unionid bivalve declines in the Clinch River, Virginia.
Abiotic Factors Underlying Stress Hormone Level Variation Among Larval Amphibians
Chambers, David L. (Virginia Tech, 2009-03-31)
Anthropogenic disturbances can alter the abiotic composition of freshwater systems. These compositional changes can act as physiological stressors towards system inhabitants. However, little is known about how these altered abiotic factors influence stress hormones (corticosterone) in larval amphibians. Throughout the following chapters, I examined the effects of several abiotic factors on baseline and stress-induced corticosterone levels in the larvae of four amphibian species: Jefferson salamander (Ambystoma jeffersonianum), spotted salamander (A. maculatum), wood frog (Rana sylvatica), and grey treefrog (Hyla versicolor). Chapter II examined corticosterone level differences throughout development in A. jeffersonianum and R. sylvatica larvae under field, mesocosm, and laboratory venues. Baseline corticosterone levels in R. sylvatica increased near metamorphic climax in all venues, but not in A. jeffersonianum. Rather, baseline corticosterone levels differed with respect to venue throughout development in A. jeffersonianum. Chapter III examined corticosterone level differences among free-living A. jeffersonianum populations and possible abiotic factors underlying these hormone differences. Corticosterone levels significantly differed across populations. Increased baseline corticosterone levels significantly correlated to low pH. There was also a trend for increased baseline corticosterone levels to be positively correlated with chloride levels and negatively correlated with conductivity. Chapter IV examined the effects of laboratory manipulated pH on corticosterone levels in A. jeffersonianum, A. maculatum, R. sylvatica, and H. versicolor. There was a significant correlation between increased baseline corticosterone levels to low pH in all four species. Prey consumption (in both Ambystoma species) and survival (in A. jeffersonianum, A. maculatum, and R. sylvatica) were also negatively correlated to low pH. Chapter V examined the effects of increased conductivity on corticosterone levels in A. jeffersonianum, R. sylvatica, and H. versicolor. Increased conductivity exposure significantly correlated to increased baseline corticosterone levels in A. jeffersonianum and R. sylvatica. Prey consumption in A. jeffersonianum was also negatively correlated to increased conductivity. My dissertation shows that abiotic factors, such as pH and conductivity, can influence corticosterone levels in larval amphibians. These results suggest that corticosterone levels in larval amphibians may be a suitable biomarker reflective of altered freshwater habitat quality. However, my results also suggest that one should use a high degree of caution when using corticosterone levels in larval amphibians as a means to infer the health status of a population.

Browse

Browsing Doctoral Dissertations by Title

Results Per Page

Sort Options