Statistical, Nonlinear, and Soft Matter Physics Commons^™

Quantics Tensor Trains: The Study Of A Continuous Lattice Model And Beyond, Aleix Bou Comas

Dissertations, Theses, and Capstone Projects

This four-chapter dissertation studies the efficient discretization of continuous variable functions with tensor train representation. The first chapter describes all the methodology used to discretize functions and store them efficiently. In this section, the algorithm tensor renormalization group is explained for self-containment purposes. The second chapter centers around the XY model. Quantics tensor trains are used to describe the transfer matrix of the model and compute one and two-dimensional quantities. The one dimensional magnitudes are compared to analytical results with an agreement close to machine precision. As for two dimensions, the analytical results cannot be computed. However, the critical temperature …

Dependence Of Energy Transfer On Curvature Similarity In Collisions Involving Curved Shock Fronts, Justin Cassell

Dissertations, Master's Theses and Master's Reports

In high-speed collisions of projectiles, pressure exerted by a resulting shock wave is so high that even solids begin to flow and hydrodynamics becomes relevant. Jetting results from hydrodynamic instability driving the evolution of an interface following shock loading. Our emphasis in this dissertation is mitigation of instabilities via several shocks and, specifically, the transfer of energy from a shock wave to another object. To that end, in 2022 and 2023 while on-site, we adapted Lawrence Livermore National Laboratory (LLNL) to explore the effects of shock front geometry on the transfer of energy during shock collisions via numerous computer simulations. …

Robust Interventions In Network Epidemiology, Erik Weis

Graduate College Dissertations and Theses

Which individual should we vaccinate to minimize the spread of a disease? Designing optimal interventions of this kind can be formalized as an optimization problem on networks, in which we have to select a budgeted number of dynamically important nodes to receive treatment that optimizes a dynamical outcome. Describing this optimization problem requires specifying the network, a model of the dynamics, and an objective for the outcome of the dynamics. In real-world contexts, these inputs are vulnerable to misspecification---the network and dynamics must be inferred from data, and the decision-maker must operationalize some (potentially abstract) goal into a mathematical objective …

Aspects Of Stochastic Geometric Mechanics In Molecular Biophysics, David Frost

All Dissertations

In confocal single-molecule FRET experiments, the joint distribution of FRET efficiency and donor lifetime distribution can reveal underlying molecular conformational dynamics via deviation from their theoretical Forster relationship. This shift is referred to as a dynamic shift. In this study, we investigate the influence of the free energy landscape in protein conformational dynamics on the dynamic shift by simulation of the associated continuum reaction coordinate Langevin dynamics, yielding a deeper understanding of the dynamic and structural information in the joint FRET efficiency and donor lifetime distribution. We develop novel Langevin models for the dye linker dynamics, including rotational dynamics, based …

When To Hold And When To Fold: Studies On The Topology Of Origami And Linkages, Mary Elizabeth Lee

Doctoral Dissertations

Linkages and mechanisms are pervasive in physics and engineering as models for a
variety of structures and systems, from jamming to biomechanics. With the increase
in physical realizations of discrete shape-changing materials, such as metamaterials,
programmable materials, and self-actuating structures, an increased understanding
of mechanisms and how they can be designed is crucial. At a basic level, linkages
or mechanisms can be understood to be rigid bars connected at pivots around which
they can rotate freely. We will have a particular focus on origami-like materials, an
extension to linkages with the added constraint of faces. Self-actuated versions typ-
ically start …

Quantifying Temperature-, Pressure-, And Nuclear Quantum Effects On Hydrophobic And Hydrophilic Water-Mediated Interactions, Justin T. Engstler

Dissertations, Theses, and Capstone Projects

Water-mediated interactions (WMIs) are responsible for diverse processes in aqueous solutions, including protein folding and nanoparticle aggregation. WMI may be affected by changes in temperature and pressure, and hence, they can alter chemical/physical processes that occur in aqueous environments. Traditionally, attention has been focused on hydrophobic interactions while, in comparison, the role of hydrophilic and hybrid (hydrophobic–hydrophilic) interactions have been mostly overlooked. Here, we study the role of T and P on the WMI between nanoscale (i) hydrophobic–hydrophobic, (ii) hydrophilic–hydrophilic, and (iii) hydrophilic–hydrophobic pairs of (hydroxylated/non-hydroxylated) graphene-based surfaces. We find that hydrophobic, hydrophilic, and hybrid interactions are all sensitive to …

Bacterial Motion And Spread In Porous Environments, Yasser Almoteri

Dissertations

Micro-swimmers are ubiquitous in nature from soil and water to mammalian bodies and even many technological processes. Common known examples are microbes such as bacteria, micro-algae and micro-plankton, cells such as spermatozoa and organisms such as nematodes. These swimmers live and have evolved in multiplex environments and complex flows in the presence of other swimmers and types, inert particles and fibers, interfaces and non-trivial confinements and more. Understanding the locomotion and interactions of these individual micro-swimmers in such impure viscous fluids is crucial to understanding the emergent dynamics of such complex systems, and to further enabling us to control and …

Deformations Of Geometrically Frustrated Elastic Sheets, Meng Xin

Doctoral Dissertations

The wrinkling and buckling of thin solids are common phenomena in our daily life and can be observed in many situations, such as crumpled papers, stretched plastics, compressed metals, clothes on our bodies and even furrowed human skin. Understanding of these phenomena has therefore long drawn interest of scholars. In this thesis, we discuss two buckling problems numerically and analytically. First, we study the wrinkling mechanism of stretched sheets with clamped edges. A central puzzle underlying this canonical example of “tensional wrinkling” has been the origin of compressive stress, which eventually leads to buckling instability. We elucidate the source of …

Experimental And Computational Aerodynamic Studies Of Axially-Oriented Low-Fineness-Ratio Cylinders, Forrest Miller

Mechanical & Aerospace Engineering Theses & Dissertations

For the successful completion of atmospheric entry, descent, and landing (EDL) missions, a body geometry must be selected which provides favorable dynamic aerodynamic properties. The types of experimental facilities capable of collecting information on these properties are limited; however, their numbers are growing thanks to the continued work by the aerodynamics community. NASA Langley Research Center (LaRC) is conducting dynamic aerodynamic testing using a subsonic magnetic suspension and balance system (MSBS), with the end goal of implementing a supersonic MSBS facility at NASA Glenn Research Center. MSBSs are also currently used at the Institute of Fluid Science (IFS) at Tohoku …

Effective Non-Hermiticity And Topology In Markovian Quadratic Bosonic Dynamics, Vincent Paul Flynn

Dartmouth College Ph.D Dissertations

Recently, there has been an explosion of interest in re-imagining many-body quantum phenomena beyond equilibrium. One such effort has extended the symmetry-protected topological (SPT) phase classification of non-interacting fermions to driven and dissipative settings, uncovering novel topological phenomena that are not known to exist in equilibrium which may have wide-ranging applications in quantum science. Similar physics in non-interacting bosonic systems has remained elusive. Even at equilibrium, an "effective non-Hermiticity" intrinsic to bosonic Hamiltonians poses theoretical challenges. While this non-Hermiticity has been acknowledged, its implications have not been explored in-depth. Beyond this dynamical peculiarity, major roadblocks have arisen in the search …

The Future Is Now In Twisted Coil Polymer Actuators (Tcpa), Ryan Ronquillo

Electronic Theses and Dissertations

This thesis aimed to fabricate and test twisted coiled polymer actuators (TCPA) to understand the mechanical and thermal aspects of this artificial muscle fiber. The purpose of this thesis was to find a linear relationship using the LVDT sensor, fabricating TCPA fibers, and interpreting the data. The project tested whether nylon/polymer could be used as a better artificial muscle fiber.

This research accomplished three goals: (1) designing and fabricating a system capable of creating supercoiled muscle fibers consistently, (2) calibrating the Linear Variable Differential Transformer (LVDT) and Core, and (3) analyzing/interpreting the data of the Twisted Coiled Polymer Actuators (TCPA) …

Path Integral Monte Carlo For Entanglement In Bosonic Lattices At T = 0, Emanuel Casiano-Diaz

Doctoral Dissertations

Path-Integral Monte Carlo Worm Algorithm is one of many Quantum Monte Carlo (QMC) methods that serve as powerful tools for the simulation of quantum many-body systems. Developed in the late 90’s, this algorithm has been used with great success to study a wide array of physical models where exact calculation of observables is not possible due to the exponential size of the Hilbert space. One type of systems that have eluded PIMC-WA implementation are lattice models at zero temperature, which are of relevance in experimental settings, such as in optical lattices of ultra-cold atoms. In this thesis, we develop a …

Black Hole Entropy In Ads/Cft And The Schwinger-Keldysh Formalism, Luke Mrini

Undergraduate Honors Theses

The Schwinger-Keldysh formalism for non-equilibrium field theory provides valuable tools for studying the black hole information loss paradox. In particular, there exists a Noether-like procedure to obtain the entropy density of a system by a discrete Kubo-Martin-Schwinger (KMS) variation of the action. Here, this Noether-like procedure is applied to the boundary action of an asymptotically anti-de Sitter (aAdS) black hole spacetime in maximally extended Kruskal coordinates. The result is the Kubo formula for shear viscosity, which is known in theories with an Einstein gravity dual to have a universal, constant ratio with the entropy density and is proportional to the …

Modelling Cell Population Growth, Mahmood Mazarei

Electronic Thesis and Dissertation Repository

The growth of biological matter, e.g., tumor invasion, depends on various factors, mainly the tissue’s mechanical properties, implying elasticity, stiffness, or apparent viscosity. These properties are impacted by the characteristics of the tissue’s extracellular matrix and constituent cells, including, but not limited to, cell membrane stiffness, cell cytoskeleton mechanical properties, and the intensity and distribution of focal adhesions over the cell membrane. To compute and study the mechanical properties of tissues during growth and confluency, a theoretical and computational framework, called CellSim3D, was developed in our group based on a three-dimensional kinetic division model.

In this work, CellSim3D is …

Analysis And Methodology Of Helical And Flexible Homopolymer Monte Carlo Simulations, Nathan Roberts

Honors College Theses

The purpose of my work is to analyze the results of Monte Carlo simulations of various types of polymers: a helical homopolymer and a flexible homopolymer. Specific applications of Monte Carlo polymer simulations and parallel tempering replica exchanges are presented. Using temporal analysis, I aim to measure the efficiency of each type of simulation as it relates to equilibration time. For the helical homopolymer model, equilibration time is expanded upon to analyze the rate of structure generation and relevant hyper-phase diagram. Stable states for helical homopolymers will use data generated from parallel tempering replica exchange Monte Carlo simulations created by …

A High-Precision Electron Emission Model: Computational Methods For Nanoscale Structures, Alister J. Tencate

Graduate Research Theses & Dissertations

The high-intensity, high-brightness and precision frontiers for charged particle beams are an increasingly important focus for study. Electron microscopy has demonstrated high quality beams from a single nanotip emitter, and cathodes of structured nanoscale arrays show promise as ultracold electron sources. Optimization of the cathode design for precision applications necessitates a detailed treatment of the interplay between the structure geometry, quantum mechanical emission mechanism, and electromagnetic interactions between the emitted electrons and the boundary interface. This dissertation details the numerical tools developed to simulate these processes efficiently with enough fidelity to be accurate even in the ultracold regime.

Conventional simulation …

Long-Range And Chaotic Active Mixing Of Swimming Microbes In A Vortex Chain Flow, Nghia Le

Honors Theses

We present experiments studying the motion and active mixing of swimming mi- crobes in laminar, vortex-dominated fluid flows. We are testing a theory that predicts the existence of swimming invariant manifolds (SwIMs) - invisible, one-way barriers blocking the paths of self-propelled tracers in the flow in one direction. We also pro- pose that the SwIMs together can form chute structures in three-dimensional phase space that facilitate cross-vortex transport of the microbes. We also observe evidence of how these structures promote long-range transport at different non-dimensional velocities (microbe’s velocity relative to flow velocity). Long-range transport is quan- tified by measuring the …

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

Theses and Dissertations

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

Probability Distributions Of The Scalar Potential, Candace Mathews

Legacy Theses & Dissertations (2009 - 2024)

In the study of cosmological inflation, string theory and supersymmetry have motivated a wide range of possible inflationary models. These models can be parameterized by a scalar potential V, which is a function of N scalar fields, and determines cosmological parameters such as the vacuum stability and energy density. In principle, we can determine V through high energy physics, such as string theory. In practice, though we may not know the details of V we might have clues about a distribution of plausible V’s, which we can build statistics on to further analyze. The purpose of this thesis defense is …

Applications Of Statistical Physics To Ecology: Ising Models And Two-Cycle Coupled Oscillators, Vahini Reddy Nareddy

Doctoral Dissertations

Many ecological systems exhibit noisy period-2 oscillations and, when they are spatially extended, they undergo phase transition from synchrony to incoherence in the Ising universality class. Period-2 cycles have two possible phases of oscillations and can be represented as two states in the bistable systems. Understanding the dynamics of ecological systems by representing their oscillations as bistable states and developing dynamical models using the tools from statistical physics to predict their future states is the focus of this thesis. As the ecological oscillators with two-cycle behavior undergo phase transitions in the Ising universality class, many features of synchrony and equilibrium …

Symmetry Breaking Effects In Low-Dimensional Quantum Systems, Ke Wang

Doctoral Dissertations

Quantum criticality in low-dimensional quantum systems is known to host exotic behaviors. In quantum one-dimension (1D), the emerging conformal group contains infinite generators, and conformal techniques, e.g., operator product expansion, give accurate and universal descriptions of underlying systems. In quantum two-dimension (2D), the electronic interaction causes singular corrections to Fermi-liquids characteristics. Meanwhile, the Dirac fermions in topological 2D materials can greatly enrich emerging phenomena. In this thesis, we study the symmetry-breaking effects of low-dimensional quantum criticality. In 1D, we consider two cases: time-reversal symmetry (TRS) breaking in the Majorana conformal field theory (CFT) and the absence of conformal symmetry in …

Frontiers In The Self-Assembly Of Charged Macromolecules, Khatcher O. Margossian

Doctoral Dissertations

The self-assembly of charged macromolecules forms the basis of all life on earth. From the synthesis and replication of nucleic acids, to the association of DNA to chromatin, to the targeting of RNA to various cellular compartments, to the astonishingly consistent folding of proteins, all life depends on the physics of the organization and dynamics of charged polymers. In this dissertation, I address several of the newest challenges in the assembly of these types of materials. First, I describe the exciting new physics of the complexation between polyzwitterions and polyelectrolytes. These materials open new questions and possibilities within the context …

Performance Analysis Of The Dominant Mode Rejection Beamformer, Enlong Hu

Dissertations

In array signal processing over challenging environments, due to the non-stationarity nature of data, it is difficult to obtain enough number of data snapshots to construct an adaptive beamformer (ABF) for detecting weak signal embedded in strong interferences. One type of adaptive method targeting for such applications is the dominant mode rejection (DMR) method, which uses a reshaped eigen-decomposition of sample covariance matrix (SCM) to define a subspace containing the dominant interferers to be rejected, thereby allowing it to detect weak signal in the presence of strong interferences. The DMR weight vector takes a form similar to the adaptive minimum …

How Dynamic Bond Results In The Unique Viscoelastic Behavior Of The Associating Polymers, Sirui Ge

Doctoral Dissertations

Associating polymer is a special kind of polymer possessing transient reversible bonds in addition to the conventional covalent bonds. The reversible bonds provide unique dynamics and fascinating viscoelastic properties, resulting in attractive applications for these polymers, such as self-healing and shape memory materials. Despite many years of studies, the understanding of dynamics of polymers with reversible bonds, especially on molecular level, is still in the rudimentary stage, preventing the rational design of the potential novel functional materials based on associating polymers. In this dissertation, we provide a detailed and quantitative understanding of the dynamics and viscoelastic properties of associating polymers. …

Direct Calculation Of Configurational Entropy: Pair Correlation Functions And Disorder, Clifton C. Sluss

Doctoral Dissertations

Techniques such as classical molecular dynamics [MD] simulation provide ready access to the thermodynamic data of model material systems. However, the calculation of the Helmholtz and Gibbs free energies remains a difficult task due to the tedious nature of extracting accurate values of the excess entropy from MD simulation data. Thermodynamic integration, a common technique for the calculation of entropy requires numerous simulations across a range of temperatures. Alternative approaches to the direct calculation of entropy based on functionals of pair correlation functions [PCF] have been developed over the years. This work builds upon the functional approach tradition by extending …

A Computational Model Of The Line-1 Retrotransposon Life Cycle And Visualization Of Metabolic Networks In 3-Dimensions., Michael D. Martin

Electronic Theses and Dissertations

Computational modeling of metabolic reactions and cellular systems is evolving as a tool for quantitative prediction of metabolic parameters and reaction pathway analysis. In this work, the basics of computational cell biology are presented as well as a summary of physical processes within the cell, and the algorithmic methods used to find time dependent solutions. Protein-protein and enzyme-substrate interactions are mathematically represented via mass action kinetics to construct sets of linear differential equations that describe reaction rates and formation of protein complexes. Using mass action methods, examples of reaction networks and their solutions are presented within the Virtual Cell simulation …

Development Of Graphical Models And Statistical Physics Motivated Approaches To Genomic Investigations, Yashwanth Lagisetty

Dissertations & Theses (Open Access)

Identifying genes involved in disease pathology has been a goal of genomic research since the early days of the field. However, as technology improves and the body of research grows, we are faced with more questions than answers. Among these is the pressing matter of our incomplete understanding of the genetic underpinnings of complex diseases. Many hypotheses offer explanations as to why direct and independent analyses of variants, as done in genome-wide association studies (GWAS), may not fully elucidate disease genetics. These range from pointing out flaws in statistical testing to invoking the complex dynamics of epigenetic processes. In the …

Collective Motion And Phase Diagram Of Self-Propelled Vibrated Hard Squares, Zhejun Shen

Doctoral Dissertations

In equilibrium, matter condenses into ordered phases due to the combined effects of inter-particle interactions and entropy. In this dissertation, we explore the self-propulsion of particles as an additional nonequilibrium consideration in the mechanisms for ordering. Our experiments employ square-shaped hard particles; in equilibrium, when particle motions are randomly directed, squares form entropically-stabilized phases in which first their orientations, and then their positions, get locked in relative to each other, depending on the density of coverage. When the square tiles are modified to have small propulsion along some body-fixed axis we find that their tendency to order is profoundly altered. …

Type I Error Rate Controlling Procedures For Multiple Hypotheses Testing, Beibei Li

Dissertations

This dissertation addresses several different but related topics arising in the field of multiple testing, including weighted procedures and graphical approaches for controlling the familywise error rate (FWER), and stepwise procedures with control of the false discovery rate (FDR) for discrete data. It consists of three major parts.

The first part investigates weighted procedures for controlling the FWER. In many statistical applications, hypotheses may be differentially weighted according to their different importance. Many weighted multiple testing procedures (wMTPs) have been developed for controlling the FWER. Among these procedures, two weighted Holm procedures are commonly used in practice: one is based …

Nonequilibrium And Nonlinear Dynamics In Collective Spin Models And Implementations Using Quantum Feedback Control, Manuel H. Munoz Arias

Physics & Astronomy ETDs

Out-of-equilibrium dynamics generalizes the study of ground states of quantum Hamiltonians at zero temperature, to that of dynamical quasi-steady states of quantum systems far from equilibrium. In this dissertation I discuss dynamical quantum phase transitions and out-of-equilibrium phases of matter in models of collective spins with multi-body interactions. These models, based on collective degrees of freedom, allow an exact description of the thermodynamic limit via the mean-field description. In this limit, the nonequilibrium dynamics of properties of quantum states is mapped to the nonlinear dynamics of classical variables, and thus it can be analyzed using tools from the theory of …