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Articles 121 - 150 of 285
Full-Text Articles in Chemistry
Near-Infrared High Efficiency Organic Dye Sensitized Solar Cells (Dscs) And Biological Fluorescent Imaging Dyes, Yanbing Zhang
Near-Infrared High Efficiency Organic Dye Sensitized Solar Cells (Dscs) And Biological Fluorescent Imaging Dyes, Yanbing Zhang
Electronic Theses and Dissertations
With the energy consumption increase every year, the non-renewable energy sources such as fossil fuels, natural gas, and coal will not sustain forever. In this case, searching for a way to develop a renewable energy source is an emergency. For decades, dye-sensitized solar cells (DSCs) have received intensive attention due to their high power conversion efficiency and low material cost. This dissertation describes efforts to design and synthesize near-infrared organic dyes to apply to two systems: first, for use in the improvement of DSCs by the optimization of electron rich components such as ullazine and cross-conjugated -bridges to increase photon-to-electricity …
Organic Sensitizers For High Efficiency Dye-Sensitized Solar Cells, Adithya Peddapuram
Organic Sensitizers For High Efficiency Dye-Sensitized Solar Cells, Adithya Peddapuram
Electronic Theses and Dissertations
After the industrial revolution in 19th-century energy, demand has increased exponentially. Relying on fossil fuels long term is not a good option due to their non-renewable nature and concerns about burning fossil fuels raising carbon dioxide levels in atmosphere. This dissertation describes, utilizing sunlight for electricity production with dye-sensitized solar cells (DSCs). DSCs are an attractive solar technology due to processing advantages over traditional solar cells. To improve the stability of DSCs, strong surface binding dyes are important. This work studies the dual anchor dual donor (DD-π-AA) dye framework with various donors (electron rich π-systems) and π-bridges (electron neutral π-systems). …
Ligand Effect On Gold Nanomolecules Demonstrated Using Aliphatic, Aromatic And Bulky Thiolate Ligands, Milan Rambukwella
Ligand Effect On Gold Nanomolecules Demonstrated Using Aliphatic, Aromatic And Bulky Thiolate Ligands, Milan Rambukwella
Electronic Theses and Dissertations
Atomically precise thiolate protected gold nanoparticles (AuNPs) known as gold nanomolecules (AuNMs) are intensely pursued owing to their feasibility to elucidate their structure by single crystal X-ray crystallography. They have distinct number of Au atoms (n) and thiolate (-SR, R-hydrocarbon chain) ligands (m) with molecular formula of the form [Aun(SR)m]. AuNMs are made of a gold core protected by a thiolate-monolayer and possess size-dependent properties conferred by quantum confinement. Atomic precision has been achieved in the 1-3 nm range and crystal structures of several AuNMs ranging from 18 to 279gold atoms have been studied. They provide significant insights into the …
Probing Atypical Noncovalent Interactions Using Electronic Structure Theory, Katelyn Mae Dreux
Probing Atypical Noncovalent Interactions Using Electronic Structure Theory, Katelyn Mae Dreux
Electronic Theses and Dissertations
Some of the most important topics in modern chemistry involve noncovalent interactions in a variety of ways, from pharmacological processes to materials design. Due to the comparatively weak nature of these interactions, they can be difficult to investigate experimentally. Beyond what might be considered the ‘typical’ noncovalent interactions such as hydrogen bonding or London dispersion, there are less well known noncovalent interactions such as coordinate covalent, dihydrogen, and nonconventional hydrogen bonding, which have been the focus of much of this research. Through the use of electronic structure theory, fundamental information about the structure, energetics, and molecular properties of noncovalently bound …
Characterization Of Hydrogen Bonding, Halogen Bonding And Argyrophilic Interactions Using Computational Modeling, Sarah Nicole Arradondo
Characterization Of Hydrogen Bonding, Halogen Bonding And Argyrophilic Interactions Using Computational Modeling, Sarah Nicole Arradondo
Electronic Theses and Dissertations
Non-covalent interactions govern multiple important chemical processes throughout nature from those within the human body to the complex environment of the atmosphere. Quantum mechanical electronic structure modeling of these relatively weak interactions can provide molecular level insight that can further our understanding of specific macroscopic properties. In the present work different non-covalent interactions are computationally evaluated within four systems. A small prototypical hydrogen bonded system and the various structural motifs that promoted proton transfer within concentrated acid and water clusters are characterized with sophisticated wavefunction based methods and large robust basis sets in order to accurately predict the structures energies …
Theranostics Based On Linear Dendritic Block Copolymers, Jon Williams
Theranostics Based On Linear Dendritic Block Copolymers, Jon Williams
Electronic Theses and Dissertations
When combining imaging and therapeutic motifs, known as theranostics, amphiphilic diblock copolymers have a strong precedent of success. These polymers can self-assemble into a variety of morphologies that are known to concentrate in areas of inflammation such as tumors. However, prediction of size and morphology from polymer structure still remains an open challenge. Another system with promise of therapeutic efficacy are tree-like struc- tures known as dendrimers, such as poly(amidoamine) (PAMAM) and bis-(hydroxymethyl) propionic acid (bMPA), which can uptake drugs and dyes into their branches. It is desireable to combine these two motifs, using linear-dendritic block copolymers (LDBCs). These represent …
Solvation Of Isoelectronic Halide And Alkali Metal Ions By Noble Gas Atoms, Carly A. Rock
Solvation Of Isoelectronic Halide And Alkali Metal Ions By Noble Gas Atoms, Carly A. Rock
Honors Theses
Alkali metal cations (M+ = Li+, Na+, K+, and Rb+), as well as their corresponding isoelectronic atomic anions (X− = H−, F−, Cl−, and Br−) were solvated with argon atoms (i.e., M+Arn and X−Arn where n=1−6). Full geometry optimizations were performed using the MP2 electronic structure method with a series of correlation consistent basis sets augmented with diffuse functions on argon and the anions (aug-cc-pVXZ) and weighted core valence basis sets were used for the cations (cc-pwCVXZ) that include the appropriate pseudopotentials for K+ and Rb+ (cc-pwCVXZ-PP). The basis sets for a particular cluster are, hereafter, simply denoted as XZ …
Synthesis Of A Novel Tetradentate Ligand And Its Copper Complex For Redox Shuttle Applications, Joseph T. Vaughan
Synthesis Of A Novel Tetradentate Ligand And Its Copper Complex For Redox Shuttle Applications, Joseph T. Vaughan
Honors Theses
With growing energy demands, alternatives to the traditional non-renewable fuel sources are currently being explored. Of these alternative fuel sources, solar energy, particularly dye-sensitized solar cells (DSSC), have garnered considerable interest. Traditional redox mediators within these solar cells have been triiodide/iodide couples, which pose several complications due to their corrosiveness, absorption in the visible range, and efficiency, motivating the development of better redox couples for next generation DSSCs. Thus, transition metal complexes have rapidly gained traction as a potential replacement for this traditional I-/I3- based system. In this study, a novel tetradentate ligand framework and its copper and nickel complexes …
Design And Development Of Chemically And Biologically Stable Salvinorin-Based Ligands For Opioid Receptors, Tanner Neilson
Design And Development Of Chemically And Biologically Stable Salvinorin-Based Ligands For Opioid Receptors, Tanner Neilson
Honors Theses
The number of opioid prescriptions as a method in pain management increased dramatically in the mid 1990’s following Dr. James Campbell’s 1995 Presidential address to the American Pain Society, where he called for patient pain to be included as a vital sign. The rapid increase in prescriptions in the early 2000’s coupled with a massive effort by pharmaceutical companies to downplay the addictiveness of these drugs has led to a consistent increase in opioid-related drug overdoses, with 47,600 of 70,237 drug related deaths involving opioids in 2017. Opioid analgesics most commonly act upon the mu-opioid receptor (MOR), which is one …
Unexpected Outcomes During The Attempted Iodination Of Biphenol, Henry Nguyen
Unexpected Outcomes During The Attempted Iodination Of Biphenol, Henry Nguyen
Honors Theses
The goal of this research was to create a new procedure to iodinate 4,4- biphenol using a ball miller. Iodination of 4,4-biphenol was first attempted in solution using electrophilic aromatic substitution. Several attempts were made to iodinate 4,4-biphenol, but the general insolubility of crude products inhibited progress. Interestingly, NMR analysis of the aqueous ammonia product suggested that 4,4-biphenol dimerized or polymerized with itself to make an ether. The exact mechanism by which the ether dimer was created is unknown, but the reaction may have occurred using a radical mechanism. Though the original goal of the project is left unmet, a …
Physical And Chemical Trace Evidence From 3d-Printed Firearms, And Use Of A Quadcopter For Targeted Sampling Of Gaseous Mercury In The Atmosphere, Oscar Beauchamp Black
Physical And Chemical Trace Evidence From 3d-Printed Firearms, And Use Of A Quadcopter For Targeted Sampling Of Gaseous Mercury In The Atmosphere, Oscar Beauchamp Black
Electronic Theses and Dissertations
My forensic research resulted in the first peer-reviepaper to address the forensic challenges presented by 3D-printed polymer firearms. The work involved a systematic approach to the analysis of evidence stemming from 3D-printed firearms filling a critical void in current forensic knowledge. We used DART-MS to characterize the polymer evidence left behind by 3D-printed firearms as well as an evaluation of pre-existing firearm and toolmark techniques and fingerprint analysis. We demonstrated that 3D-printed firearms leave behind characteristic polymer residue on cartridge cases bullets and the receiving surface which can be identified using DART-MS. The culmination of the work includes a database …
Electrochemical Studies Involving Co2 Reduction With Rhenium-Based Catalysts And For Guanosine Monophosphate Oxidation, Kayla A. Milano
Electrochemical Studies Involving Co2 Reduction With Rhenium-Based Catalysts And For Guanosine Monophosphate Oxidation, Kayla A. Milano
Electronic Theses and Dissertations
The following chapter of this thesis will cover the oxidation of guanine monophosphate (GMP). GMP has been linked to numerous conditions when it is oxidized or damaged. There have been two oxidation pathways suggested in association to the oxidation of GMP: EPT and MS-EPT. The ideal conditions for GMP’s oxidation is still be studied and collected. The study focuses on the acetate versus phosphate buffer, varying base concentration in phosphate buffer, and the varying concentration of ruthenium complex, a redox mediator.
The Synthesis Of New Donor-Sigma-Acceptor Compounds As Potential Current Rectifiers, Trey Gautier Vaughan
The Synthesis Of New Donor-Sigma-Acceptor Compounds As Potential Current Rectifiers, Trey Gautier Vaughan
Electronic Theses and Dissertations
The zwitterionic D-σ-A’s are characterized by having an anionic donor, a cationic acceptor, an intervening sigma-bond bridge, and an aliphatic tail. The aliphatic tail is of such length as to impart greater solubility in organic solvents since the formal charges on the donor and acceptor lead to poor solubility. Additionally, the aliphatic tail is required for Pockels-Langmuir deposition to facilitate the favorable van der Waal’s packing when combined to form dense monolayer registries. These monolayers may then be suitable for measuring the bulk electrical properties.
A Study To Regioselectively Access Fluorinated Triazoles And Isoxazoles, Sweta Adhikari
A Study To Regioselectively Access Fluorinated Triazoles And Isoxazoles, Sweta Adhikari
Electronic Theses and Dissertations
The objective of the thesis is to develop regioselective methods for mono-fluorination of disubstituted triazoles, both 1,4- and 1,5-regioisomer, and isoxazoles. These strategies focus on one-pot direct access to final mono-fluorinated triazoles and isoxazoles. Eventually, these fluorinated substrates will be screened against various biological targets. Similarly, the optimization study of a regioselective method to generate 5-fluoro-1,4-disubstituted triazole was conducted. This reaction also utilized 1,3-dipolar cycloaddition to synthesize fluorinated triazole. However, difluoroalkene was used as a synthetic equivalent of fluoroalkyne for this method. This resulted into the inversion of polarity affording a different regioisomer. Here, fluoronitroalkene was identified as a synthetic …
High Voltage Dye-Sensitized Solar Cells And Molecular Photocatalysis For Co2 Reduction, Roberta Ramalho Rodrigues
High Voltage Dye-Sensitized Solar Cells And Molecular Photocatalysis For Co2 Reduction, Roberta Ramalho Rodrigues
Electronic Theses and Dissertations
The development of high voltage solar cells is an attractive way to use sunlight to power electrocatalysts for water oxidation, electrocatalysts for CO2 reduction, and consumer electronics. Through careful molecular dye engineering and redox shuttle pairing, our group has reported a single-junction dye-sensitized solar cell (DSC) employing, for the first time, an iron redox mediator (Fe(bpy)33+/2+) in conjunction with a novel wide band gap dye (RR9). This system generates a high photovoltage of 1.42 V. To the best of our knowledge, this system is the highest photovoltage achieved by a single-junction DSC device without metal oxide doping. The RR9/Fe(bpy)33+/2+ redox …
Intramoleculer Hydrogen Bonding In Epoxide, Thiirane, Aziridine And Phosphirane Containing Cyclopentanols, Ben Edward Smith
Intramoleculer Hydrogen Bonding In Epoxide, Thiirane, Aziridine And Phosphirane Containing Cyclopentanols, Ben Edward Smith
Electronic Theses and Dissertations
A recent computational analysis of the stabilizing intramolecular OH· · · O contact in 1,2-dialkyl-2,3-epoxycyclopentanol diastereomers has been extended to thiiriane, aziridine and phosphirane analogues. Density functional theory (DFT), second-order Møller-Plesset perturbation theory (MP2) and CCSD(T) coupled-cluster computations with simple methyl and ethyl substituents indicate that electronic energies of the cis isomers are lowered by roughly 3 to 4 kcal mol−1 when the OH group of these cyclopentanol systems forms an intramolecular contact with the O, S, N or P atom on the adjacent carbon. The results also suggest that S and P can participate in these stabilizing intramolecular interactions …
Bulky Thiolated Gold Nanomolecules: Synthesis, Characterization, Optical Properties, And Atomic Structure, Tanya Clorise Jones
Bulky Thiolated Gold Nanomolecules: Synthesis, Characterization, Optical Properties, And Atomic Structure, Tanya Clorise Jones
Electronic Theses and Dissertations
Gold nanomolecules (NMs) have a distinct number of gold atoms and thiolate ligands, Aux(SR)y, with unique spectroscopic, electrochemical, and chiral properties which are dependent on “x” and “y”. The properties of NMs are dictated by the type of capping ligand. The overall structure, size, surface percentage of ligands, and structure of an entire gold NM is changed based on the type of ligand used to synthesize it. Ligand type, such as aliphatic, aromatic or bulky play a crucial role in determining the size and composition of such NMs. A NM’s composition and properties vary widely depending on the type of …
X-Ray Crystal Structure Of Au36(Sph-Pch3)24 Nanomolecules, Vigneshraja Ganeshraj
X-Ray Crystal Structure Of Au36(Sph-Pch3)24 Nanomolecules, Vigneshraja Ganeshraj
Electronic Theses and Dissertations
Au36(SR)24 is one of the most comNanomolecules (NM) in gold NM field and crystal structures of Au36(SR)24 with different thiolate protecting ligand such as tert-butylbenzene thiol, thiophenol and cyclopentane thiol have been reported. It has been predicted that aromatic thiol protected Au36(SR)24 NM have same core structures like the other reported Au36(SR)24 NMs. Due to the steric and electronic conjugation effects the staples on the gold core exhibit minor changes in the bond length without affecting the gold core. By varying the Gold:Thiol ratio the NM size can be controlled. Herein, we report the synthesis, isolation and characterization of two …
Development Of Cobalt And Iron Catalysts Bearing Rigid Polydentate Ligands For Proton Reduction And C-H Bond Oxidation, Lizhu Chen
Electronic Theses and Dissertations
The demand for energy consumption has increased exponentially since the Industrial Revolution. The major source of this energy has been and continues to be fossil fuels. The depletion of fossil fuels and environmental concerns associated with their combustion has motivated us to develop a renewable energy alternative to meet future energy demands. Hydrogen is a clean energy alternative to fossil fuels, which can be generated from solar-driven water splitting. However, more efficient and inexpensive catalysts for the hydrogen evolution reaction (HER) are needed. In this context, hydrogen production has been investigated with a stable and highly reactive cobalt-based catalyst. While …
A Computational Approach To Predicting And Understanding New Psychoactive Substances (Nps) For Developing A Database For State And Federal Crime Laboratories, Caroline Amelia Spencer
A Computational Approach To Predicting And Understanding New Psychoactive Substances (Nps) For Developing A Database For State And Federal Crime Laboratories, Caroline Amelia Spencer
Electronic Theses and Dissertations
The object of this dissertation was to use a computational approach to predict and understand new psychoactive substances (NPS) to develop a database for state and federal crime. The primary scope of the dissertation was to better understand the interactions that take place between new psychoactive substances and their corresponding receptors. Through analysis of the interactions between the amino acids within the receptors and the NPS an understanding into the pharmacology and toxicology of these drugs can be gained. NPS such as synthetic cannabinoids fentanyl and its analogs and kratom have become more problematic for both state and federal crime …
Effects Of Halogen Bonding And Nir Tuning Of Dyes For Dye-Sensitized Solar Cells, Alexandra Baumann
Effects Of Halogen Bonding And Nir Tuning Of Dyes For Dye-Sensitized Solar Cells, Alexandra Baumann
Electronic Theses and Dissertations
With current energy demands being met through the utilization of energy sources such as petroleum, natural gas, and coal, the non-renewable nature of these sources will eventually approach depletion as world wide energy consumption increases yearly. As a result the need for a renewable energy alternative has become imminent. One appealing alternative that has gained considerable attention since its development due to a low cost and a high solar to electric conversion efficiency are dye-sensitized solar cells (DSCs). This dissertation describes efforts to design and synthesize improved organic dyes utilizing three analogous methods: first, through decreasing non-productive pathways such as …
Community-Based Research Methods To Inform Public Health Practice And Policy: The Case Of Lead In The Mississippi Delta, Mary Alexandra Fratesi
Community-Based Research Methods To Inform Public Health Practice And Policy: The Case Of Lead In The Mississippi Delta, Mary Alexandra Fratesi
Honors Theses
Environmental health issues are complex and require interdisciplinary and community engagement approaches to better understand them and inform policy. As one example, lead exposure has a number of dangerous neurological effects, including developmental delays and learning deficits. Potential lead exposure through drinking water and paint are areas of concern. In a 2018 document, the Environmental Protection Agency (EPA) estimated that up to 20% of lead exposure comes from drinking water alone. By using a type of engagement research called community-based research (CBR), this project began to address this major public health issue. CBR can be used to connect residents, their …
Electro- And Photocatalytic Carbon Dioxide Reduction With Mononuclear And Dinuclear Rhenium Polypyridyl Complexes, Eva Amatya
Honors Theses
The main challenge of reducing carbon dioxide (CO2) to value-added products lies in designing more efficient catalysts that are long-lived, selective, and operate near the thermodynamic potential for the reaction. In this work, mononuclear and dinuclear Re complexes containing diamine ligands linked to a pendant anthracene moiety have been synthesized and studied for both electrocatalytic and photocatalytic CO2 reduction. Electrocatalytically, the performances of both catalysts were studied in N,N-dimethylformamide (DMF) and acetonitrile (MeCN) solutions to determine their turnover frequencies (TOFs) for CO2 reduction. Catalyst performance was compared to previously reported rhenium systems, and both systems studied here were shown to …
Post-Translational Modification Of Hypoxia-Inducible Factor Proteins By O-Linked -N-Acetylglucosamine In Breast Cancer Cells, Sean Williamson
Post-Translational Modification Of Hypoxia-Inducible Factor Proteins By O-Linked -N-Acetylglucosamine In Breast Cancer Cells, Sean Williamson
Honors Theses
One of the hallmarks of cancer is its ability to adapt its metabolism to survive and thrive despite needing to overcome significant energy barriers and low oxygen settings in order to do so. The hypoxia-inducible factor proteins (HIFs) play important roles in the processes in which cancer fulfills these requirements. The O-linked -N-acetylglucoseamine (O-GlcNAc) can be attached to cellular proteins through O-glycosylation, and is thus considered a potential target for anticancer mechanisms. HIFs are composed of (HIF-1 and HIF-2, respectively) and subunits. This research found that O-GlcNAc is able to attach to and modify the HIF proteins. This was accomplished …
Computational Investigation On Electronic Structures And Properties Of 4,6-Bis(Nitroimino)-1,3,5-Triazinan-2-One: An Insensitive Munitions Compound, Katarina M. Pittman
Computational Investigation On Electronic Structures And Properties Of 4,6-Bis(Nitroimino)-1,3,5-Triazinan-2-One: An Insensitive Munitions Compound, Katarina M. Pittman
Honors Theses
In order to minimize unintentional detonation, current munitions research has focused on the development of chemical compounds that are insensitive to external stimuli whilst maintaining their effectiveness. While these compounds, known as high performance in- sensitive munitions compounds, are promising in terms of potency and stability, their envi- ronmental impacts have either not been fully understood or are yet to be investigated. In the present research, we have performed a computational chemistry investigation on electronic structures and properties of an insensitive munition compound 4,6-bis(nitroimino)-1,3,5- triazinan-2-one (DNAM). The Density Functional Theory using the B3LYP and M06- 2X functionals and MP2 methodology …
Raman Spectroscopic And Computational Study Of Hydrogen Bond Interactions Between Guanidine Hydrochloride, Trimethylamine N-Oxide (Tmao), Urea, And Water, Andrew Kamischke
Raman Spectroscopic And Computational Study Of Hydrogen Bond Interactions Between Guanidine Hydrochloride, Trimethylamine N-Oxide (Tmao), Urea, And Water, Andrew Kamischke
Honors Theses
Proteins are broken down in the body and produce water, CO2, and ammonia as by-products. Ammonia is toxic to cells, making it a priority to be excreted. Urea is the key route for the transportation of ammonia out of the body and is the main component of urine. Guanidine is another important nitrogen-containing molecule that is structural like urea and plays important biological roles in the stabilization of proteins. Guanidine hydrochloride and Urea are known to denature proteins and this functionality continues to be a topic of great interest. Urea and guanidine contain many hydrogen bonding sites and interactions with …
Assembly Of A Protein-Based Hydrogel As A Vehicle For In Situ Drug Delivery, Austin Carroll
Assembly Of A Protein-Based Hydrogel As A Vehicle For In Situ Drug Delivery, Austin Carroll
Honors Theses
The goal of this work is to develop a self-assembling, protein-based gel to deliver drugs at the site of chronic inflammation. There are two engineered protomers that comprise the gel; calmodulin- and M13- are their critical components. Numerous enzymes have been shown to undergo calcium-dependent regulation by calmodulin, an intracellular protein highly resilient to its chemical environment. One of these enzymes, myosin light chain kinase, contains a remarkable 26 residue portion known as the M13 peptide that has been demonstrated to bind to calmodulin in the presence of calcium through hydrophobic interactions. Because the extracellular space in vivo constitutes an …
Studies Of Carbonaceous Materials Using Raman Spectroscopy, Cameron L. Smith
Studies Of Carbonaceous Materials Using Raman Spectroscopy, Cameron L. Smith
Honors Theses
Various carbonaceous materials including graphene, treated biochar, and C60 were studied using Raman spectroscopy with particular attention given to the treatment process and the Raman enhancement methods. Such studies that focus on the treatment process are useful in determining the extent to which the species was affected via shifts in the Raman peaks. Previous collaborations have proven successful when multiple samples were studied and analyzed. The attempt to create a novel Raman enhancement technique via combination of two previously recorded techniques was ultimately unsuccessful but further work is necessary.
Heterobifunctional Linear Dendritic Block Co-Polymers (Ldbcs) As Multifunctional Carriers For Targeted Drug Delivery, William Rieger
Heterobifunctional Linear Dendritic Block Co-Polymers (Ldbcs) As Multifunctional Carriers For Targeted Drug Delivery, William Rieger
Honors Theses
Despite current research towards applications of polymeric drug delivery systems (DDSs) in biomedical research, significant limitations—specifically in synthetic accessibility, bio compatibility, and principles of molecular self-assembly—have been discerned. To address these drawbacks, we will investigate the synthesis and characterization of heterobifunctional linear-dendritic block copolymers (LDBCs), which combine the advantageous properties of both linear and dendritic blocks to afford nanomaterials with superior mechanical properties. Our LDBC systems contain two differing functional constituents, namely a hydrophilic polyamidoamine (PAMAM) dendron covalently linked to a hydrophobic polyester (polylactic acid, or PLA), and can self-assemble to form nanoparticles of various morphologies that serve as the …
Electrocatalytic Oxygen Reduction Studies On Gold Nanoparticles, Leigh Sumner
Electrocatalytic Oxygen Reduction Studies On Gold Nanoparticles, Leigh Sumner
Honors Theses
After determining that the size of nanoclusters can be tuned such that they have a precise formula much like a chemical compound, much is still not known about nanoclusters, their properties, and how they interact if core size, ligand, and even environment is changed. One such mystery is how does the size of the nanoparticle tune its ability as a catalyst. As it is known that nanoparticles possess unique properties, studies have begun to look towards nanoclusters as catalysts for alternative forms of energy. Therefore, determining how size affects the ability of a nanoparticle catalyst becomes a very important question. …