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Description
Improved knowledge connecting the chemistry, structure, and properties of polymers is necessary to develop advanced materials in a materials-by-design approach. Molecular dynamics (MD) simulations can provide tremendous insight into how the fine details of chemistry, molecular architecture, and microstructure affect many physical properties; however, they face well-known restrictions in their

Improved knowledge connecting the chemistry, structure, and properties of polymers is necessary to develop advanced materials in a materials-by-design approach. Molecular dynamics (MD) simulations can provide tremendous insight into how the fine details of chemistry, molecular architecture, and microstructure affect many physical properties; however, they face well-known restrictions in their applicable temporal and spatial scales. These limitations have motivated the development of computationally-efficient, coarse-grained methods to investigate how microstructural details affect thermophysical properties. In this dissertation, I summarize my research work in structure-based coarse-graining methods to establish the link between molecular-scale structure and macroscopic properties of two different polymers. Systematically coarse-grained models were developed to study the viscoelastic stress response of polyurea, a copolymer that segregates into rigid and viscous phases, at time scales characteristic of blast and impact loading. With the application of appropriate scaling parameters, the coarse-grained models can predict viscoelastic properties with a speed up of 5-6 orders of magnitude relative to the atomistic MD models. Coarse-grained models of polyethylene were also created to investigate the thermomechanical material response under shock loading. As structure-based coarse-grained methods are generally not transferable to states different from which they were calibrated at, their applicability for modeling non-equilibrium processes such as shock and impact is highly limited. To address this problem, a new model is developed that incorporates many-body interactions and is calibrated across a range of different thermodynamic states using a least square minimization scheme. The new model is validated by comparing shock Hugoniot properties with atomistic and experimental data for polyethylene. Lastly, a high fidelity coarse-grained model of polyethylene was constructed that reproduces the joint-probability distributions of structural variables such as the distributions of bond lengths and bond angles between sequential coarse-grained sites along polymer chains. This new model accurately represents the structure of both the amorphous and crystal phases of polyethylene and enabling investigation of how polymer processing such as cold-drawing and bulk crystallization affect material structure at significantly larger time and length scales than traditional molecular simulations.
ContributorsAgrawal, Vipin (Author) / Oswald, Jay (Thesis advisor) / Peralta, Pedro (Committee member) / Chamberlin, Ralph (Committee member) / Solanki, Kiran (Committee member) / Jiao, Yang (Committee member) / Arizona State University (Publisher)
Created2016
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Description
Characterization and modeling of deformation and failure in metallic materials under extreme conditions, such as the high loads and strain rates found under shock loading due to explosive detonation and high velocity-impacts, are extremely important for a wide variety of military and industrial applications. When a shock wave causes stress

Characterization and modeling of deformation and failure in metallic materials under extreme conditions, such as the high loads and strain rates found under shock loading due to explosive detonation and high velocity-impacts, are extremely important for a wide variety of military and industrial applications. When a shock wave causes stress in a material that exceeds the elastic limit, plasticity and eventually spallation occur in the material. The process of spall fracture, which in ductile materials stems from strain localization, void nucleation, growth and coalescence, can be caused by microstructural heterogeneity. The analysis of void nucleation performed from a microstructurally explicit simulation of a spall damage evolution in a multicrystalline copper indicated triple junctions as the preferred sites for incipient damage nucleation revealing 75% of them with at least two grain boundaries with misorientation angle between 20-55°. The analysis suggested the nature of the boundaries connecting at a triple junction is an indicator of their tendency to localize spall damage. The results also showed that damage propagated preferentially into one of the high angle boundaries after voids nucleate at triple junctions. Recently the Rayleigh-Taylor Instability (RTI) and the Richtmyer-Meshkov Instability (RMI) have been used to deduce dynamic material strength at very high pressures and strain rates. The RMI is used in this work since it allows using precise diagnostics such as Transient Imaging Displacement Interferometry (TIDI) due to its slower linear growth rate. The Preston-Tonks-Wallace (PTW) model is used to study the effects of dynamic strength on the behavior of samples with a fed-thru RMI, induced via direct laser drive on a perturbed surface, on stability of the shock front and the dynamic evolution of the amplitudes and velocities of the perturbation imprinted on the back (flat) surface by the perturbed shock front. Simulation results clearly showed that the amplitude of the hydrodynamic instability increases with a decrease in strength and vice versa and that the amplitude of the perturbed shock front produced by the fed-thru RMI is also affected by strength in the same way, which provides an alternative to amplitude measurements to study strength effects under dynamic conditions. Simulation results also indicate the presence of second harmonics in the surface perturbation after a certain time, which were also affected by the material strength.
ContributorsGautam, Sudrishti (Author) / Peralta, Pedro (Thesis advisor) / Oswald, Jay (Committee member) / Solanki, Kiran (Committee member) / Arizona State University (Publisher)
Created2016
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Description
The study of response of various materials to intense dynamic loading events,

such as shock loading due to high-velocity impacts, is extremely important in a wide

variety of military and industrial applications. Shock loading triggers extreme states,

leading to high pressures and strain rates, and neglecting strength is a typical

approximation under such conditions.

The study of response of various materials to intense dynamic loading events,

such as shock loading due to high-velocity impacts, is extremely important in a wide

variety of military and industrial applications. Shock loading triggers extreme states,

leading to high pressures and strain rates, and neglecting strength is a typical

approximation under such conditions. However, recent results have shown that strength

effects are larger than expected, so they must be taken into account. Recently,

hydrodynamic instabilities, the most common being the Rayleigh-Taylor (RTI) and

Richtmyer-Meshkov (RMI) instabilities, have been used to infer the dynamic strength of

materials at high pressure conditions. In our experiments and simulations, a novel RMI

approach is used, in which periodic surface perturbations are made on high purity

aluminium target, which was laser ablated to create a rippled shock front. Due to the

slow linear growth rate of RMI, the evolution of the perturbations on the back surface of

the sample as a result of the rippled shock can be measured via Transient Imaging

Displacement Interferometry (TIDI). The velocity history at the free surface was

recorded by spatially resolved laser velocimetry. These measurements were compared

with the results from the simulations, which were implemented using rate independent

and rate dependent material models, to characterize the dynamic strength of the

material. Simulations using the elastic-perfectly plastic model, which is rate

independent, failed to provide a value of dynamic yield strength that would match

experimental measurements of perturbation amplitudes. The Preston-Tonks-Wallace

(PTW) model, which is rate dependent model, worked well for aluminium. This model

was, in turn, used as a reference for calibrating the rate dependent Steinberg-Lund

model and the results from simulations using the calibration models were also compared

to experimental measurements.
ContributorsGopalakrishnan, Ashish (Author) / Peralta, Pedro (Thesis advisor) / Rajagopalan, Jagannathan (Committee member) / Solanki, Kiran (Committee member) / Arizona State University (Publisher)
Created2017
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Description
Nanocrystalline (NC) and Ultrafine-grained (UFG) metal films exhibit a wide range of enhanced mechanical properties compared to their coarse-grained counterparts. These properties, such as very high strength, primarily arise from the change in the underlying deformation mechanisms. Experimental and simulation studies have shown that because of the small grain size,

Nanocrystalline (NC) and Ultrafine-grained (UFG) metal films exhibit a wide range of enhanced mechanical properties compared to their coarse-grained counterparts. These properties, such as very high strength, primarily arise from the change in the underlying deformation mechanisms. Experimental and simulation studies have shown that because of the small grain size, conventional dislocation plasticity is curtailed in these materials and grain boundary mediated mechanisms become more important. Although the deformation behavior and the underlying mechanisms in these materials have been investigated in depth, relatively little attention has been focused on the inhomogeneous nature of their microstructure (particularly originating from the texture of the film) and its influence on their macroscopic response. Furthermore, the rate dependency of mechanical response in NC/UFG metal films with different textures has not been systematically investigated. The objectives of this dissertation are two-fold.

The first objective is to carry out a systematic investigation of the mechanical behavior of NC/UFG thin films with different textures under different loading rates. This includes a novel approach to study the effect of texture-induced plastic anisotropy on mechanical behavior of the films. Efforts are made to correlate the behavior of UFG metal films and the underlying deformation mechanisms. The second objective is to understand the deformation mechanisms of UFG aluminum films using in-situ transmission electron microscopy (TEM) experiments with Automated Crystal Orientation Mapping. This technique enables us to investigate grain rotations in UFG Al films and to monitor the microstructural changes in these films during deformation, thereby revealing detailed information about the deformation mechanisms prevalent in UFG metal films.
ContributorsIzadi, Ehsan (Author) / Rajagopalan, Jagannathan (Thesis advisor) / Peralta, Pedro (Committee member) / Chawla, Nikhilesh (Committee member) / Solanki, Kiran (Committee member) / Oswald, Jay (Committee member) / Arizona State University (Publisher)
Created2017
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Description
Robotic joints can be either powered or passive. This work will discuss the creation of a passive and a powered joint system as well as the combination system being both powered and passive along with its benefits. A novel approach of analysis and control of the combination system

Robotic joints can be either powered or passive. This work will discuss the creation of a passive and a powered joint system as well as the combination system being both powered and passive along with its benefits. A novel approach of analysis and control of the combination system is presented.

A passive and a powered ankle joint system is developed and fit to the field of prosthetics, specifically ankle joint replacement for able bodied gait. The general 1 DOF robotic joint designs are examined and the results from testing are discussed. Achievements in this area include the able bodied gait like behavior of passive systems for slow walking speeds. For higher walking speeds the powered ankle system is capable of adding the necessary energy to propel the user forward and remain similar to able bodied gait, effectively replacing the calf muscle. While running has not fully been achieved through past powered ankle devices the full power necessary is reached in this work for running and sprinting while achieving 4x’s power amplification through the powered ankle mechanism.

A theoretical approach to robotic joints is then analyzed in order to combine the advantages of both passive and powered systems. Energy methods are shown to provide a correct behavioral analysis of any robotic joint system. Manipulation of the energy curves and mechanism coupler curves allows real time joint behavioral adjustment. Such a powered joint can be adjusted to passively achieve desired behavior for different speeds and environmental needs. The effects on joint moment and stiffness from adjusting one type of mechanism is presented.
ContributorsHolgate, Robert (Author) / Sugar, Thomas (Thesis advisor) / Artemiades, Panagiotis (Thesis advisor) / Berman, Spring (Committee member) / Mignolet, Marc (Committee member) / Davidson, Joseph (Committee member) / Arizona State University (Publisher)
Created2017
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Description
Hydrodynamic phenomena such as the Rayleigh-Taylor (RT) and Richtmyer-Meshkov (RM) instabilities can be described by exponential/linear growth of surface perturbations at a bimaterial interface when subjected to constant/impulsive acceleration. A challenge in designing systems to mitigate or exploit these effects is the lack of accurate material models at large dynamic

Hydrodynamic phenomena such as the Rayleigh-Taylor (RT) and Richtmyer-Meshkov (RM) instabilities can be described by exponential/linear growth of surface perturbations at a bimaterial interface when subjected to constant/impulsive acceleration. A challenge in designing systems to mitigate or exploit these effects is the lack of accurate material models at large dynamic strain rates and pressures. In particular, little stress-strain constitutive information at large strain rates and pressures is available for transient material phases formed at high pressures, and the continuum effect the phase transformation process has on the instability evolution. In this work, a phase-aware isotropic strength model is developed and partially validated with a novel RM-based instability experiment in addition to existing data from the literature. With the validated material model additional simulations are performed to provide insight into to the role that robust material constitutive behavior (e.g., pressure, temperature, rate dependence) has on RM instability and how RM instability experiments can be used to characterize and validated expected material behavior. For phase aware materials, particularly iron in this work, the simulations predict a strong dependence on the Atwood number that single phase materials do not have. At Atwood numbers close to unity, and pressures in the high pressure stability region, the high pressure phase dominates the RM evolution. However, at Atwood numbers close to negative one, the RM evolution is only weakly affected by the high-pressure phase even for shocks well above the phase transformation threshold. In addition to RM evolution this work looks at the closely related shock front perturbation evolution. Existing analytical models for isentropic processes in gases and liquids are modified for metal equation of states and plastic behavior for the first time. It is found that the presence of a volume collapsing phase transformation with increased pressure causes shock front perturbations to decay sooner, while plastic strength has the opposite effect which is significantly different from the effect viscosity has. These results suggest additional experimental setups to validate material models, or relevant material parameters that can be optimized for system design objectives, e.g., minimize feed through perturbations in inertial confinement fusion capsules.
ContributorsOpie, Saul (Author) / Peralta, Pedro (Thesis advisor) / Loomis, Eric (Committee member) / Oswald, Jay (Committee member) / Rajan, Subramaniam D. (Committee member) / Solanki, Kiran (Committee member) / Arizona State University (Publisher)
Created2017
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Description
The greenhouse gases in the atmosphere have reached a highest level due to high number of vehicles. A Fuel Cell Hybrid Electric Vehicle (FCHEV) has zero greenhouse gas emissions compared to conventional ICE vehicles or Hybrid Electric Vehicles and hence is a better alternative. All Electric Vehicle (AEVs) have longer

The greenhouse gases in the atmosphere have reached a highest level due to high number of vehicles. A Fuel Cell Hybrid Electric Vehicle (FCHEV) has zero greenhouse gas emissions compared to conventional ICE vehicles or Hybrid Electric Vehicles and hence is a better alternative. All Electric Vehicle (AEVs) have longer charging time which is unfavorable. A fully charged battery gives less range compared to a FCHEV with a full hydrogen tank. So FCHEV has an advantage of a quick fuel up and more mileage than AEVs. A Proton Electron Membrane Fuel Cell (PEMFC) is the commonly used kind of fuel cell vehicles but it possesses slow current dynamics and hence not suitable to be the sole power source in a vehicle. Therefore, improving the transient power capabilities of fuel cell to satisfy the road load demand is critical.

This research studies integration of Ultra-Capacitor (UC) to FCHEV. The objective is to analyze the effect of integrating UCs on the transient response of FCHEV powertrain. UCs has higher power density which can overcome slow dynamics of fuel cell. A power management strategy utilizing peak power shaving strategy is implemented. The goal is to decrease power load on batteries and operate fuel cell stack in it’s most efficient region. Complete model to simulate the physical behavior of UC-Integrated FCHEV (UC-FCHEV) is developed using Matlab/SIMULINK. The fuel cell polarization curve is utilized to devise operating points of the fuel cell to maintain its operation at most efficient region. Results show reduction of hydrogen consumption in aggressive US06 drive cycle from 0.29 kg per drive cycle to 0.12 kg. The maximum charge/discharge battery current was reduced from 286 amperes to 110 amperes in US06 drive cycle. Results for the FUDS drive cycle show a reduction in fuel consumption from 0.18 kg to 0.05 kg in one drive cycle. This reduction in current increases the life of the battery since its protected from overcurrent. The SOC profile of the battery also shows that the battery is not discharged to its minimum threshold which increasing the health of the battery based on number of charge/discharge cycles.
ContributorsJethani, Puneet V. (Author) / Mayyas, Abdel (Thesis advisor) / Berman, Spring (Committee member) / Ren, Yi (Committee member) / Arizona State University (Publisher)
Created2017
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Description
The advancements in the technology of MEMS fabrication has been phenomenal in recent years. In no mean measure this has been the result of continued demand from the consumer electronics market to make devices smaller and better. MEMS inertial measuring units (IMUs) have found revolutionary applications in a wide array

The advancements in the technology of MEMS fabrication has been phenomenal in recent years. In no mean measure this has been the result of continued demand from the consumer electronics market to make devices smaller and better. MEMS inertial measuring units (IMUs) have found revolutionary applications in a wide array of fields like medical instrumentation, navigation, attitude stabilization and virtual reality. It has to be noted though that for advanced applications of motion tracking, navigation and guidance the cost of the IMUs is still pretty high. This is mainly because the process of calibration and signal processing used to get highly stable results from MEMS IMU is an expensive and time-consuming process. Also to be noted is the inevitability of using external sensors like GPS or camera for aiding the IMU data due to the error propagation in IMU measurements adds to the complexity of the system.

First an efficient technique is proposed to acquire clean and stable data from unaided IMU measurements and then proceed to use that system for tracking human motion. First part of this report details the design and development of the low-cost inertial measuring system ‘yIMU’. This thesis intends to bring together seemingly independent techniques that were highly application specific into one monolithic algorithm that is computationally efficient for generating reliable orientation estimates. Second part, systematically deals with development of a tracking routine for human limb movements. The validity of the system has then been verified.

The central idea is that in most cases the use of expensive MEMS IMUs is not warranted if robust smart algorithms can be deployed to gather data at a fraction of the cost. A low-cost prototype has been developed comparable to tactical grade performance for under $15 hardware. In order to further the practicability of this device we have applied it to human motion tracking with excellent results. The commerciality of device has hence been thoroughly established.
ContributorsShetty, Yatiraj K (Author) / Redkar, Sangram (Thesis advisor) / Sugar, Thomas (Committee member) / Berman, Spring (Committee member) / Lee, Hyunglae (Committee member) / Arizona State University (Publisher)
Created2016
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Description
The environmental impact of the fossil fuels has increased tremendously in the last decade. This impact is one of the most contributing factors of global warming. This research aims to reduce the amount of fuel consumed by vehicles through optimizing the control scheme for the future route information. Taking advantage

The environmental impact of the fossil fuels has increased tremendously in the last decade. This impact is one of the most contributing factors of global warming. This research aims to reduce the amount of fuel consumed by vehicles through optimizing the control scheme for the future route information. Taking advantage of more degrees of freedom available within PHEV, HEV, and FCHEV “energy management” allows more margin to maximize efficiency in the propulsion systems. The application focuses on reducing the energy consumption in vehicles by acquiring information about the road grade. Road elevations are obtained by use of Geographic Information System (GIS) maps to optimize the controller. The optimization is then reflected on the powertrain of the vehicle.The approach uses a Model Predictive Control (MPC) algorithm that allows the energy management strategy to leverage road grade to prepare the vehicle for minimizing energy consumption during an uphill and potential energy harvesting during a downhill. The control algorithm will predict future energy/power requirements of the vehicle and optimize the performance by instructing the power split between the internal combustion engine (ICE) and the electric-drive system. Allowing for more efficient operation and higher performance of the PHEV, and HEV. Implementation of different strategies, such as MPC and Dynamic Programming (DP), is considered for optimizing energy management systems. These strategies are utilized to have a low processing time. This approach allows the optimization to be integrated with ADAS applications, using current technology for implementable real time applications.

The Thesis presents multiple control strategies designed, implemented, and tested using real-world road elevation data from three different routes. Initial simulation based results show significant energy savings. The savings range between 11.84% and 25.5% for both Rule Based (RB) and DP strategies on the real world tested routes. Future work will take advantage of vehicle connectivity and ADAS systems to utilize Vehicle to Vehicle (V2V), Vehicle to Infrastructure (V2I), traffic information, and sensor fusion to further optimize the PHEV and HEV toward more energy efficient operation.
ContributorsAlzorgan, Mohammad (Author) / Mayyas, Abdel Ra’ouf (Thesis advisor) / Berman, Spring (Committee member) / Ren, Yi (Committee member) / Arizona State University (Publisher)
Created2016
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Description
Wearable robotics is a growing sector in the robotics industry, they can increase the productivity of workers and soldiers and can restore some of the lost function to people with disabilities. Wearable robots should be comfortable, easy to use, and intuitive. Robust control methods are needed for wearable robots that

Wearable robotics is a growing sector in the robotics industry, they can increase the productivity of workers and soldiers and can restore some of the lost function to people with disabilities. Wearable robots should be comfortable, easy to use, and intuitive. Robust control methods are needed for wearable robots that assist periodic motion.

This dissertation studies a phase based oscillator constructed with a second order dynamic system and a forcing function based on the phase angle of the system. This produces a bounded control signal that can alter the damping and stiffens properties of the dynamic system. It is shown analytically and experimentally that it is stable and robust. It can handle perturbations remarkably well. The forcing function uses the states of the system to produces stable oscillations. Also, this work shows the use of the phase based oscillator in wearable robots to assist periodic human motion focusing on assisting the hip motion. One of the main problems to assist periodic motion properly is to determine the frequency of the signal. The phase oscillator eliminates this problem because the signal always has the correct frequency. The input requires the position and velocity of the system. Additionally, the simplicity of the controller allows for simple implementation.
ContributorsDe la Fuente Valadez, Juan Oziel (Author) / Sugar, Thomas G. (Committee member) / Redkar, Sangram (Committee member) / Berman, Spring (Committee member) / Artemiadis, Panagiotis (Committee member) / Schroeder, Kyle A (Committee member) / Arizona State University (Publisher)
Created2016