Nanoscience and Nanotechnology Commons^™

Computational Rational Design Of Electrocatalysts For Electrochemical Ammonia And Hydrogen Synthesis, Akash Jain

Doctoral Dissertations

The electrochemical hydrogen evolution reaction (HER) and nitrogen reduction reaction (NRR) offer fossil-fuel-free routes for hydrogen and ammonia synthesis, respectively. However, currently, both processes lack suitable electrocatalysts for practical applications. Thus, this dissertation focuses on the computational rational design of HER and NRR electrocatalysts.

HER is most efficiently catalyzed by platinum (Pt), which is expensive. To reduce the catalyst cost, we investigate core-shell nanoparticles of inexpensive tungsten-carbide (WC) and Pt (WC@Pt). Using first-principles density functional theory (DFT) calculations, we compare the suitability of two WC phases, α-WC and β-WC as support materials for Pt overlayers. We dope WC with titanium …

Closed-Loop Control Of Meltpool Temperature In Directed Energy Deposition, Ziyad M. Smoqi, Ben Bevans, Aniruddha Gaikwad, James Craig, Alan Abul-Haj, Brent Roeder, Bill Macy, Jeffrey E. Shield, Prahalada K. Rao

Mechanical & Materials Engineering Faculty Publications

The objective of this work is to mitigate flaw formation in powder and laser-based directed energy deposition (DED) additive manufacturing process through close-loop control of the meltpool temperature. In this work, the meltpool temperature was controlled by modulating the laser power based on feedback signals from a coaxial two-wavelength imaging pyrometer. The utility of closed-loop control in DED is demonstrated in the context of practically inspired trapezoid-shaped stainlesssteel parts (SS 316L). We demonstrate that parts built under closed-loop control have reduced variation in porosity and uniform microstructure compared to parts built under open-loop conditions. For example, post-process characterization showed that …

Efficient Capture Of Co2 And Its Selective Reduction To Formic Acid Using Tin-Based Nanomaterials, Emmanuel Oluwaseun Abdul

Dissertations and Theses

CO₂ emissions from the combustion of fossil fuels and other anthropogenic sources have become the main contributing factors to global warming. Chemical methods of absorbing/capturing CO₂ from combustion flue gases have made it a sought-after approach in engineering emission solutions because of its simplistic and convenient operation and high absorption efficiency. The conversion of CO₂ into renewable fuels and high energy density chemicals by clean and economic processes has drawn scientists' attention over the decades. The electrocatalytic conversion of CO₂ using Sn-based materials has been demonstrated to be a promising method for producing formate, an important …

Random Lasing In Nano-Crystalline Zinc-Oxide Films, Benito Reynaldo Resendiz

Dissertations and Theses

In this thesis, we explore the preparation of random lasers (RLs) using solution-deposited, randomly packed nano-particle films of zinc oxide (ZnO) impregnated with silicon dioxide (SiO₂) nanospheres. RLs have their scatterers randomly oriented, while their lasing comes from light propagating along closed paths through the scattering environment. It is shown here that random lasing is readily observed in films made of submicron sized ZnO particles. Adding transparent SiO₂ nanospheres to the films, we show there is an effective improvement of the lasing that is observable in all of the samples spectra. Specifically, we found that the lasing …

Controlling The Emission Of Volatile Platinum Oxides To The Vapor Phase In Diesel Oxidation Catalysts, Arnab Ghosh

Nanoscience and Microsystems ETDs

Pt-based catalysts are used for the treatment of emissions from vehicles, particularly in Diesel oxidation catalysts (DOCs). Three-way catalysts are treated at temperatures ranging from 950℃-1050℃ while DOCs are aged at 800℃ for 50 hrs. At 800°C, Pt reacts with O₂ to form PtO₂ which has a high vapor pressure and can be transported through the vapor phase. These accelerated aging conditions lead to the formation of large Pt particles causing a loss of catalytic activity. In this thesis, we used model thin-film catalysts that made it possible to quantify the emission of Pt to the vapor phase …

Multiscale Models Of Interfacial Mechanics In Low Dimensional Systems, Christopher Price

Publicly Accessible Penn Dissertations

Crucial thrusts in modern technology from electronic information processing to engineering cellular systems require manipulation and control of materials on smaller and smaller scales to succeed. A simple and successful way to break conventional material property limitations or design multifunctional devices is to interface two different materials together. At small length scales, the surface to bulk ratio of each component material increases, to the point that the interfacial physics can dominate the properties of the engineered system. Simultaneously, the combinatorial space of possible interfaces between materials and/or molecules is far too vast to explore by trial-and-error experimentation alone. Intuitive theoretical …

A Materials Study Of Topological Insulators And Two-Dimensional Ferromagnets, Sarah Friedensen

Publicly Accessible Penn Dissertations

Topological insulators and two-dimensional ferromagnetic materials are novel phases with wideranging applications including quantum computing, spintronics, and other advanced electronic devices with the potential for ultrathin and ultralow-power wearables. TEM, AFM, EDS, Ramanspectroscopy, and low-temperature transport measurement are used to characterize an unusual superconducting alloy formed between palladium and bismuth selenide under low-temperature annealing. TEM, AFM, and EDS are used to perform a materials study of metallic nickel and niobium annealed with Bi2Se3 under similar conditions, with the conclusion that Ni reacts to form a diffuse layer within Bi2Se3 flakes that travels along edges and line defects, and Nb does …

Polymer Dynamics In Disordered Nanoparticle Packings: Effect Of Confinement, Interfaces, And Humidity, R Bharath Venkatesh

Publicly Accessible Penn Dissertations

Infiltration of polymers into disordered nanoparticle packings has shown to be a powerful method of fabricating highly loaded nanocomposites with superb mechanical properties. Polymer-infiltrated nanoparticle packings provide a unique platform to study the dynamics of macromolecules under extreme nanoconfinement. The degree of confinement can be tuned by appropriate choice of particle size and polymer molecular weight. The presence of large interfacial area between the polymer and the particle, high degree of nanoconfinement, and environmental triggers like atmospheric humidity can impact the dynamics of polymers at the segmental and the chain level. By using tools like microscopy, ellipsometry and molecular dynamic …

Phase-Changing Nanodroplets As Nanotheranostic Platform For Combination Cancer Therapy, Catalina-Paula Spatarelu

Dartmouth College Ph.D Dissertations

Cancer is a cluster of diseases, and 1.8 million Americans are newly diagnosed each year. Treatment issues such as drug instability, the occurrence of severe side effects, as well as resistance make the need for solutions to improve conventional methods, like chemotherapy, apparent. Nano-sized drug-delivery platforms, particles loaded with therapeutic molecules that escape the immune system clearance and accumulate at the tumor site, were proposed as one of these solutions. Despite the expansion of the field, several aspects still need to be addressed: inconsistent delivery of the drugs, inability of measuring the effective dose being delivered to the tumor, lack …

Inventions In The Area Of Nanomaterials And Nanotechnologies. Part Ii, Leonid A. Ivanov, Li Da Xu, Svetlana R. Muminova, Valentina M. Feoktistova, Elena V. Romanova

Information Technology & Decision Sciences Faculty Publications

Introduction. Advanced technologies impress people’s imagination demonstrating the latest achievements (materials, methods, systems, technologies, devices etc.) that dramatically change the world. This, first of all, concerns nanotechnological inventions designed by scientists, engineers and specialists from different countries. Main part. The article provides an abstract overview of inventions of scientists, engineers and specialists from different countries: Germany, Russia, USA, et al. The results of the creative activity of scientists, engineers and specialists, including inventions in the field of nanotechnology and nanomaterials allow, when introduced to industry, achieving a significant effect in construction, housing and communal services, and related sectors of the …

Inventions In The Area Of Nanomaterials And Nanotechnologies. Part I, Leonid A. Ivanov, Li Da Xu, Elena S. Bokova, Aleksandr D. Ishkov, Oksana N. Borisova

Information Technology & Decision Sciences Faculty Publications

Introduction. Advanced technologies impress people’s imagination demonstrating the latest achievements (materials, methods, systems, technologies, devices etc.) that dramatically change the world. This, first of all, concerns nanotechnological inventions designed by scientists, engineers and specialists from different countries. Main part. The article provides an abstract overview of inventions of scientists, engineers and specialists from different countries: Germany, Iraq, China, Russia, USA, Ukraine, Sweden, Japan et al. The results of the creative activity of scientists, engineers and specialists, including inventions in the field of nanotechnology and nanomaterials allow, when introduced to industry, achieving a significant effect in construction, housing and communal services, …

Inventions In The Area Of Nanomaterials And Nanotechnologies. Part Iii, Leonid A. Ivanov, Li Da Xu, Svetlana R. Muminova, Aleksandr D. Ishkov, Aleksey V. Demenev

Information Technology & Decision Sciences Faculty Publications

Introduction. Advanced technologies inspire people by demonstrating the latest achievements (materials, methods, systems, technologies, devices etc.) that dramatically change the world. This, first of all, concerns nanotechnological inventions designed by scientists, engineers and specialists from different countries. Main part. The article provides an abstract overview of inventions of scientists, engineers and specialists from different countries: Russia, USA, Turkmenistan, Japan et al. The results of the creative activity of scientists, engineers and specialists, including inventions in the field of nanotechnology and nanomaterials allow, when introduced to industry, achieving a significant effect in construction, housing and communal services, and related sectors of …

Molecular Modeling Of High-Performance Thermoset Polymer Matrix Composites For Aerospace Applications, Prathamesh P. Deshpande

Dissertations, Master's Theses and Master's Reports

The global efforts from major space agencies to transport humans to Mars will require a novel lightweight and ultra-high strength material for the spacecraft structure. Three decades of research with the carbon nanotubes (CNTs) have proved that the material can be an ideal candidate for the composite reinforcement if certain shortcomings are overcome. Also, the rapid development of the polymer resin industry has introduced a wide range of high-performance resins that show high compatibility with the graphitic surface of the CNTs. This research explores the computational design of these materials and evaluates their efficacy as the next generation of aerospace …

Exploring Novel Materials To Be Used As Dual-Energy Mammography Contrast Agents For Breast Cancer Detection, Lenitza Nieves Lopez

Publicly Accessible Penn Dissertations

Dual-energy mammography (DEM) is a recently FDA-approved x-ray imaging technology developed for breast cancer screening, especially advantageous for women with dense breasts. While studies have reported the benefits of DEM in breast cancer screening, thus far, no DEM-specific contrast agents have been approved. Therefore, clinics use iodinated contrast agents, which can have suboptimal contrast in DEM, short circulation half-life, and adverse effects on patients. Nanoparticle-based contrast agents can be designed to address some of these limitations. This thesis explores different materials to develop DEM-specific nanoparticle-based contrast agents with high contrast and biocompatibility. Based on previous research highlighting elements that produce …

Characterization Of Nanoparticles Using Inductively-Coupled Plasma Mass Spectrometry, Jabez D. Campbell

MSU Graduate Theses

Nanomaterials are a relatively new class of materials that have many applications which span a wide host of fields from medical products to consumer products. The possible compositions and forms of nanomaterials are just as varied as the applications. Therefore, a versatile characterization method is needed for researchers and regulators alike to ensure nanomaterials are properly used. Single Particle Inductively Coupled Plasma Mass Spectrometry (SP-ICP-MS) is a functional method that could fill the characterization need in the nanomaterial research field. Using data from both SP-ICP-MS tests and data from literature established characterization methods, the viability of making SP-ICP-MS the standard …

Flexible Battery-Less Wireless Glucose Monitoring System, Saikat Banerjee, Gymama Slaughter

Bioelectrics Publications

In this work, a low power microcontroller-based near field communication (NFC) interfaced with a flexible abiotic glucose hybrid fuel cell is designed to function as a battery-less glucose sensor. The abiotic glucose fuel cell is fabricated by depositing colloidal platinum (co–Pt) on the anodic region and silver oxide nanoparticles-multiwalled carbon nanotubes (Ag₂O-MWCNTs) composite on the cathodic region. The electrochemical behavior is characterized using cyclic voltammetry and chronoamperometry. This glucose hybrid fuel cell generated an open circuit voltage of 0.46 V, short circuit current density of 0.444 mA/cm2, and maximum power density of 0.062 mW/cm² at 0.26 V …

Recent Advances In Biosensors For Detection Of Covid-19 And Other Viruses, Shobhit K. Patel, Jaymit Surve, Juveriya Parmar, Kawsar Ahmed, Francis M. Bui, Fahad Ahmed Al-Zahrani

Mechanical & Materials Engineering Faculty Publications

This century has introduced very deadly, dangerous, and infectious diseases to humankind such as the influenza virus, Ebola virus, Zika virus, and the most infectious SARS-CoV-2 commonly known as COVID-19 and have caused epidemics and pandemics across the globe. For some of these diseases, proper medications, and vaccinations are missing and the early detection of these viruses will be critical to saving the patients. And even the vaccines are available for COVID-19, the new variants of COVID-19 such as Delta, and Omicron are spreading at large. The available virus detection techniques take a long time, are costly, and complex and …

Recent Advances In Biosensors For Detection Of Covid-19 And Other Viruses, Shobhit K. Patel, Jaymit Surve, Juveriya Parmar, Kawsar Ahmed, Francis M. Bui, Fahad Ahmed Al-Zahrani

Mechanical & Materials Engineering Faculty Publications

This century has introduced very deadly, dangerous, and infectious diseases to humankind such as the influenza virus, Ebola virus, Zika virus, and the most infectious SARS-CoV-2 commonly known as COVID-19 and have caused epidemics and pandemics across the globe. For some of these diseases, proper medications, and vaccinations are missing and the early detection of these viruses will be critical to saving the patients. And even the vaccines are available for COVID-19, the new variants of COVID-19 such as Delta, and Omicron are spreading at large. The available virus detection techniques take a long time, are costly, and complex and …

A Robot-Assisted Acoustofluidic End Effector, Jan Durrer, Prajwal Agrawal, Ali Ozgul, Stephen C.F. Neuhauss, Nitesh Nama, Daniel Ahmed

Mechanical & Materials Engineering Faculty Publications

Liquid manipulation is the foundation of most laboratory processes. For macroscale liquid handling, both do-it-yourself and commercial robotic systems are available; however, for microscale, reagents are expensive and sample preparation is difficult. Over the last decade, lab-on-a-chip (LOC) systems have come to serve for microscale liquid manipulation; however, lacking automation andmulti-functionality. Despite their potential synergies, each has grown separately and no suitable interface yet exists to link macro-level robotics with micro-level LOC or microfluidic devices. Here, we present a robot-assisted acoustofluidic end effector (RAEE) system, comprising a robotic arm and an acoustofluidic end effector, that combines robotics and microfluidic functionalities.We …

Type Iii And Iv Deformation Twins In Minerals And Metals, John P. Hirth, Greg Hirth, Jian Wang

Mechanical & Materials Engineering Faculty Publications

Type IV twins are defined and shown to exist in triclinic crystal systems, as well as in some monoclinic and trigonal systems. Here, we focus on Pericline twins in triclinic plagioclase as an example. Type IV twins are associated with the irrationality of one of the twinning elements that is rational for a type II twin. The formation of type IV twins is accomplished through the shear on a K2 plane produced by the motion of twinning disconnections on a K1 plane, followed by rotational partitioning. The same systems where type IV twins are present also have type III twins …