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Articles 31 - 60 of 107
Full-Text Articles in Materials Science and Engineering
Flexible Nanopaper Composed Of Wood-Derived Nanofibrillated Cellulose And Graphene Building Blocks, Qing Li, Ming Dai, Xueren Qian, Tian Liu, Zhenbo Liu, Yu Liu, Ming Chen, Wang He, Suqing Zeng, Yu Meng, Chenchen Dai, Jing Shen, Yingtao Liu, Wenshuai Chen, Wenbo Liu, Ping Lu
Flexible Nanopaper Composed Of Wood-Derived Nanofibrillated Cellulose And Graphene Building Blocks, Qing Li, Ming Dai, Xueren Qian, Tian Liu, Zhenbo Liu, Yu Liu, Ming Chen, Wang He, Suqing Zeng, Yu Meng, Chenchen Dai, Jing Shen, Yingtao Liu, Wenshuai Chen, Wenbo Liu, Ping Lu
College of Science & Mathematics Departmental Research
Nanopaper has attracted considerable interest in the fields of films and paper research. However, the challenge of integrating the many advantages of nanopaper still remains. Herein, we developed a facile strategy to fabricate multifunctional nanocomposite paper (NGCP) composed of wood-derived nanofibrillated cellulose (NFC) and graphene as building blocks. NFC suspension was consisted of long and entangled NFCs (10–30 nm in width) and their aggregates. Before NGCP formation, NFC was chemically modified with a silane coupling agent to ensure that it could interact strongly with graphene in NGCP. The resulting NGCP samples were flexible and could be bent repeatedly without any …
Doping Graphene With Substitutional Mn, Pin-Cheng Lin, Renan Villarreal, Simona Achilli, Harsh Bana, Maya N. Nair, Antonio Tejeda, Ken Verguts, Stefan De Gendt, Manuel Auge, Hans Hofsäss, Steven De Feyter, Giovanni Di Santo, Luca Petaccia, Steven Brems, Guido Fratesi, Lino M. C. Pereira
Doping Graphene With Substitutional Mn, Pin-Cheng Lin, Renan Villarreal, Simona Achilli, Harsh Bana, Maya N. Nair, Antonio Tejeda, Ken Verguts, Stefan De Gendt, Manuel Auge, Hans Hofsäss, Steven De Feyter, Giovanni Di Santo, Luca Petaccia, Steven Brems, Guido Fratesi, Lino M. C. Pereira
Advanced Science Research Center
We report the incorporation of substitutional Mn atoms in high-quality, epitaxial graphene on Cu(111), using ultralow-energy ion implantation. We characterize in detail the atomic structure of substitutional Mn in a single carbon vacancy and quantify its concentration. In particular, we are able to determine the position of substitutional Mn atoms with respect to the Moiré superstructure (i.e., local graphene-Cu stacking symmetry) and to the carbon sublattice; in the out-of-plane direction, substitutional Mn atoms are found to be slightly displaced toward the Cu surface, that is, effectively underneath the graphene layer. Regarding electronic properties, we show that graphene doped with substitutional …
Semi-Empirical Modeling Of Liquid Carbon's Containerless Solidification, Philip C. Chrostoski
Semi-Empirical Modeling Of Liquid Carbon's Containerless Solidification, Philip C. Chrostoski
Doctoral Dissertations
“Elemental carbon has important structural diversity, ranging from nanotubes through graphite to diamond. Previous studies of micron-size core/rim carbon spheres extracted from primitive meteorites suggest they formed around such stars via the solidification of condensed carbon-vapor droplets, followed by gas-to-solid carbon coating to form the graphite rims. Similar core/rim particles result from the slow cooling of carbon vapor in the lab. The long-range carbon bond-order potential was used to computationally study liquid-like carbon in (1.8 g/cm3) periodic boundary (tiled-cube supercell) and containerless (isolated cluster) settings. Relaxations via conjugate-gradient and simulated-annealing nucleation and growth simulations using molecular dynamics were …
Two New Finite Element Schemes And Their Analysis For Modeling Of Wave Propagation In Graphene, Jichun Li
Two New Finite Element Schemes And Their Analysis For Modeling Of Wave Propagation In Graphene, Jichun Li
Mathematical Sciences Faculty Research
© 2020 The Author(s) In this paper, we investigate a system of governing equations for modeling wave propagation in graphene. Compared to our previous work (Yang et al., 2020), here we re-investigate the governing equations by eliminating two auxiliary unknowns from the original model. A totally new stability for the model is established for the first time. Since the finite element scheme proposed in Yang et al. (2020) is only first order in time, here we propose two new schemes with second order convergence in time for the simplified modeling equations. Discrete stabilities inheriting exactly the same form as the …
Additive Manufacturing Of Graphene-Based Devices For Flexible Hybrid Electronics, Twinkle Pandhi
Additive Manufacturing Of Graphene-Based Devices For Flexible Hybrid Electronics, Twinkle Pandhi
Boise State University Theses and Dissertations
In this work, I investigate and enhance the fundamental sensing properties of printed electronic nanomaterials (e.g., graphene) in real-world environments while decreasing weight, cost, and power consumption. The dissertation addresses this issue with the following foci in mind: (1) developing a straightforward and repeatable process to synthesize graphene ink which is also compatible with Inkjet-printing (IJP) and Aerosol Jet printing (AJP). (2) Tuning additive manufacturing printing (IJP and AJP) parameters to establish a repeatable manufacturing process and print high performing (graphene-based) electrodes and interconnects, compatible with the underlying substrate. (3) Investigate power dissipation and electrical breakdown in AJP printed graphene …
A Review Of Inkjet Printed Graphene And Carbon Nanotubes Based Gas Sensors, Twinkle Pandhi, Ashita Chandnani, Harish Subbaraman, David Estrada
A Review Of Inkjet Printed Graphene And Carbon Nanotubes Based Gas Sensors, Twinkle Pandhi, Ashita Chandnani, Harish Subbaraman, David Estrada
Materials Science and Engineering Faculty Publications and Presentations
Graphene and carbon nanotube (CNT)-based gas/vapor sensors have gained much traction for numerous applications over the last decade due to their excellent sensing performance at ambient conditions. Inkjet printing various forms of graphene (reduced graphene oxide or modified graphene) and CNT (single-wall nanotubes (SWNTs) or multiwall nanotubes (MWNTs)) nanomaterials allows fabrication onto flexible substrates which enable gas sensing applications in flexible electronics. This review focuses on their recent developments and provides an overview of the state-of-the-art in inkjet printing of graphene and CNT based sensors targeting gases, such as NO2, Cl2, CO2, NH3 …
Ordered Mesoporous Carbon/Graphene/Nickel Foam For Flexible Dopamine Detection With Ultrahigh Sensitivity And Selectivity, Lai-Yu Wang, Xin Xi, Dong-Qing Wu, Xiong-Yu Liu, Wei Ji, Rui-Li Liu
Ordered Mesoporous Carbon/Graphene/Nickel Foam For Flexible Dopamine Detection With Ultrahigh Sensitivity And Selectivity, Lai-Yu Wang, Xin Xi, Dong-Qing Wu, Xiong-Yu Liu, Wei Ji, Rui-Li Liu
Journal of Electrochemistry
Electro-catalytic reduction is an efficient way to achieve resourcable transformation of CO2, which is one of the important techniques to solve the global environmental problems originated from excessive CO2 emission. In this study, a membrane electrode assembly(MEA) type CO2 electro-reduction electrolytic cell was constucted, which enables CO2 feeding and real-time KHCO3 aqueous updating on both sides of the cathode gas diffusion electrode (GDE). By means of the electrolytic cell, effects of KHCO3 concentration and updating inside the liquid electrolytic chamber on CO2 electro-reduction activity, production distribution and stability were investigated. The experimental …
Carbon Oxidation At The Atomic Level: A Computational Study On Oxidative Graphene Etching And Pitting Of Graphitic Carbon Surfaces, Simon Schmitt
Carbon Oxidation At The Atomic Level: A Computational Study On Oxidative Graphene Etching And Pitting Of Graphitic Carbon Surfaces, Simon Schmitt
Theses and Dissertations--Mechanical and Aerospace Engineering
In order to understand the oxidation of solid carbon materials by oxygen-containing gases, carbon oxidation has to be studied on the atomic level where the surface reactions occur. Graphene and graphite are etched by oxygen to form characteristic pits that are scattered across the material surface, and pitting in turn leads to microstructural changes that determine the macroscopic oxidation behavior. While this is a well-documented phenomenon, it is heretofore poorly understood due to the notorious difficulty of experiments and a lack of comprehensive computational studies. The main objective of the present work is the development of a computational framework from …
Synthesis Of Graphene Using Plasma Etching And Atmospheric Pressure Annealing: Process And Sensor Development, Andrew Robert Graves
Synthesis Of Graphene Using Plasma Etching And Atmospheric Pressure Annealing: Process And Sensor Development, Andrew Robert Graves
Graduate Theses, Dissertations, and Problem Reports (ETD)
Having been theorized in 1947, it was not until 2004 that graphene was first isolated. In the years since its isolation, graphene has been the subject of intense, world-wide study due to its incredibly diverse array of useful properties. Even though many billions of dollars have been spent on its development, graphene has yet to break out of the laboratory and penetrate mainstream industrial applications markets. This is because graphene faces a ‘grand challenge.’ Simply put, there is currently no method of manufacturing high-quality graphene on the industrial scale. This grand challenge looms particularly large for electronic applications where the …
Electrochemical Properties Of Sulfur In Different Carbon Support Materials, Bo Zhang, Jia Liu, Xiao-Chen Liu, De-Jun Li
Electrochemical Properties Of Sulfur In Different Carbon Support Materials, Bo Zhang, Jia Liu, Xiao-Chen Liu, De-Jun Li
Journal of Electrochemistry
In order to investigate the effect of carbon structure on electrochemical performance of sulfur/carbon composite in lithium-sulfur battery, in this paper, sublimation sulfur was incorporated into three types of carbon materials, namely, graphene, carbon black and porous carbon. The three sulfur/carbon composites were characterized by scanning electron microscopy (SEM), Brunauer-Emmett-Teller (BET), and X-ray diffraction (XRD) techniques, and their electrochemical performances were also studied. The results showed that the sulfur/porous carbon composite offered an initial discharge capacity of 1623.2 mA·h·g-1 and remained 845 mA·h·g-1 after 100 cycles. Compared with graphene and carbon black, the mesopores and micropores in porous …
Graphene/Polypropylene Nanocomposites, Carmen Karam Abuoudah
Graphene/Polypropylene Nanocomposites, Carmen Karam Abuoudah
Theses
Graphene has been regarded as a multifunctional nanofiller for manufacturing polymer nanocomposites. A small amount of graphene nanosheets is expected to significantly improve the properties of base polymers. The property enhancement, however, is a function of the degree of exfoliation and dispersion of graphene as well as its compatibility with the polymer. The non-polar nature of polyolefins such as polyethylene (PE) and polypropylene (PP) restricts the homogeneous dispersion of graphene, leading to significant agglomeration of the nanosheets and thus, limiting the expected property improvements in polyolefins. Currently, more efforts are focused on finding strategies to improve graphene dispersion in polyolefins. …
Surface-Enhanced Raman Detection Of Glucose On Several Novel Substrates For Biosensing Applications, Laila Saad Alqarni
Surface-Enhanced Raman Detection Of Glucose On Several Novel Substrates For Biosensing Applications, Laila Saad Alqarni
Dissertations
The small normal Raman cross-section of glucose is considered to be a major challenge for its detection by Surface Enhanced Raman Spectroscopy (SERS) for medical applications. These applications include blood glucose level monitoring of diabetic patients and evaluation of patients with other medical conditions, since glucose is a marker for many human diseases. This dissertation focuses on Surface-Enhanced Raman Scattering primarily for the detection of glucose. Some experiments also are carried out for the detection of the corresponding enzyme glucose oxidase that is used in electrochemical glucose sensors and in biofuel cells. This project explores the possibility of utilizing Surface …
Exploring The Electrical Properties Of Twisted Bilayer Graphene, William Shannon
Exploring The Electrical Properties Of Twisted Bilayer Graphene, William Shannon
Senior Theses
Two-dimensional materials exhibit properties unlike anything else seen in conventional substances. Electrons in these materials are confined to move only in the plane. In order to explore the effects of these materials, we have built apparatus and refined procedures with which to create two-dimensional structures. Two-dimensional devices have been made using exfoliated graphene and placed on gold contacts. Their topography has been observed using Atomic Force Microscopy (AFM) confirming samples with monolayer, bilayer, and twisted bilayer structure. Relative work functions of each have been measured using Kelvin Probe Force Microscopy (KPFM) showing that twisted bilayer graphene has a surface potential …
Plasmonic Properties Of Nanoparticle And Two Dimensional Material Integrated Structure, Desalegn Tadesse Debu
Plasmonic Properties Of Nanoparticle And Two Dimensional Material Integrated Structure, Desalegn Tadesse Debu
Graduate Theses and Dissertations
Recently, various groups have demonstrated nano-scale engineering of nanostructures for optical to infrared wavelength plasmonic applications. Most fabrication technique processes, especially those using noble metals, requires an adhesion layer. Previously proposed theoretical work to support experimental measurement often neglect the effect of the adhesion layers. The first finding of this work focuses on the impact of the adhesion layer on nanoparticle plasmonic properties. Gold nanodisks with a titanium adhesion layer are investigated by calculating the scattering, absorption, and extinction cross-section with numerical simulations using a finite difference time domain (FDTD) method. I demonstrate that a gold nanodisk with an adhesive …
Modelling Palladium Decorated Graphene Using Density Functional Theory To Analyze Hydrogen Sensing Application, Sameer Kulkarni
Modelling Palladium Decorated Graphene Using Density Functional Theory To Analyze Hydrogen Sensing Application, Sameer Kulkarni
Mechanical Engineering Undergraduate Honors Theses
Graphene is an exciting new material with many promising applications. One such application of graphene is gas sensing, when adsorbed with transition metals, notably Palladium. Therefore, it is of paramount importance to have appropriate ab initio calculations to calculate the various properties of graphene under different adsorbates and gasses. The first step in these calculations is to have a functioning base Density Functional Theory (DFT) model of pristine graphene decorated with Palladium. The computational methods described in this paper has yielded results for pristine graphene that have been confirmed many times in previous experimental and theoretical studies. Future work needs …
Thermal Transport In Layer-By-Layer Assembled Polycrystalline Graphene Films, David Estrada, Alondra Perez
Thermal Transport In Layer-By-Layer Assembled Polycrystalline Graphene Films, David Estrada, Alondra Perez
Materials Science and Engineering Faculty Publications and Presentations
New technologies are emerging which allow us to manipulate and assemble 2-dimensional (2D) building blocks, such as graphene, into synthetic van der Waals (vdW) solids. Assembly of such vdW solids has enabled novel electronic devices and could lead to control over anisotropic thermal properties through tuning of inter-layer coupling and phonon scattering. Here we report the systematic control of heat flow in graphene-based vdW solids assembled in a layer-by-layer (LBL) fashion. In-plane thermal measurements (between 100 K and 400 K) reveal substrate and grain boundary scattering limit thermal transport in vdW solids composed of one to four transferred layers of …
Open-Source Automated Chemical Vapor Deposition System For The Production Of Two-Dimensional Nanomaterials, Lizandra Williams-Godwin, Dale Brown, Richard Livingston, Tyler Webb, Lynn Karriem, Elton Graugnard, David Estrada
Open-Source Automated Chemical Vapor Deposition System For The Production Of Two-Dimensional Nanomaterials, Lizandra Williams-Godwin, Dale Brown, Richard Livingston, Tyler Webb, Lynn Karriem, Elton Graugnard, David Estrada
Materials Science and Engineering Faculty Publications and Presentations
The study of two- dimensional (2D) materials is a rapidly growing area within nanomaterials research. However, the high equipment costs, which include the processing systems necessary for creating these materials, can be a barrier to entry for some researchers interested in studying these novel materials. Such process systems include those used for chemical vapor deposition, a preferred method for making these materials. To address this challenge, this article presents the first open-source design for an automated chemical vapor deposition system that can be built for less than a third of the cost for a comparable commercial system. The materials and …
Scanning Probe Microscopy Measurements On 2d Materials And Iridates, Armin Ansary
Scanning Probe Microscopy Measurements On 2d Materials And Iridates, Armin Ansary
Theses and Dissertations--Physics and Astronomy
In the past two decades, there has been a quest to understand and utilize novel materials such as iridates and two-dimensional (2D) materials. These classes of materials show a lot of interesting properties both in theoretical predictions as well as experimental results. Physical properties of some of these materials have been investigated using scanning probe measurements, along with other techniques.
One-dimensional (1D) catalytic etching was investigated in few-layer hexagonal boron nitride (hBN) films. Etching of hBN was shown to share several similarities with that of graphitic films. As in graphitic films, etch tracks in hBN commenced at film edges and …
Electrical Characterization Of Graphene And Nanodiamond Nanostructures, A Z M Nowzesh Hasan
Electrical Characterization Of Graphene And Nanodiamond Nanostructures, A Z M Nowzesh Hasan
Doctoral Dissertations
The electrical characterization on two-dimensional carbon-based graphene and nanodiamond materials was performed to improve charge transport properties for the label-free electrical biosensors. The charge transport in solution-gated graphene devices is affected by the impurities and disorders of the underlying dielectric interface and its interaction with the electrolytes. Advancement in field-effect ion sensing by introducing a dielectric isomorph, hexagonal boron nitride between graphene and silicon dioxide of a solution-gated graphene field-effect transistor was investigated. Increased transconductance due to increased charge carrier mobility is accompanied with larger ionic sensitivity. These findings define a standard to construct future graphene devices for biosensing and …
Measuring The Double Layer Capacitance Of Electrolyte Solutions Using A Graphene Field Effect Transistor, Agatha Ulibarri
Measuring The Double Layer Capacitance Of Electrolyte Solutions Using A Graphene Field Effect Transistor, Agatha Ulibarri
Senior Theses
When operating graphene field effect transistors (GFETs) in fluid, a double layer capacitance (Cdl) is formed at the surface. In the literature, the Cdl is estimated using values obtained using metal electrode experiments. Due to the distinctive electronic and surface properties of graphene, there is reason to believe these estimates are inadequate. This work seeks to directly characterize the double layer capacitance of a GFET. A unique method for determining the Cdl has been implemented, and data has been obtained for three electrolytes and one ionic fluid. The results yield dramatically lower Cdl values than …
The Incorporation Of Graphene To Lithium Cobalt Oxide As A Cathode To Improve The Performance Of Lithium Ion Batteries, Kenan Wang
Graduate Theses and Dissertations
One of the objectives of this thesis work was to investigate the cathode performance of lithium cobalt oxide (LiCoO2) incorporated with graphene powder in lithium ion batteries (LIBs). Graphene powder was incorporated into cathode materials to enhance the performance of LIBs. The other objective was to impede the construction of a solid electrolyte interphase (SEI) sheet using graphene sheet coating on its cathode.
The results of this work show that adding graphene powder improved the performance of LiCoO¬2 as a cathode material. With the incorporation of different weight percentages of graphene powder, the LiBs showed distinct changes in their charging …
Polymer Nanocomposites Containing High Aspect Ratio Particulates: Innovation In Co-Extruded Multilayer Barrier Films, Kevin Meyers
Polymer Nanocomposites Containing High Aspect Ratio Particulates: Innovation In Co-Extruded Multilayer Barrier Films, Kevin Meyers
Dissertations
Delaminated montmorillonite (MMT) clay/ maleic anhydride grafted LLDPE nanocomposite multilayer films with alternating layers of LDPE were produced through multilayer co-extrusion. The MMT concentration within the nanocomposite layers was increased through annealing the films in the melt due to a mismatch in interdiffusion rates of the polymer layers. Analysis of the nanocomposite layers upon annealing revealed that the platelets impinged upon one another resulting in significant improvement in oxygen barrier in the multilayer system, exceeding the results of bulk nanocomposites.
Model analysis demonstrated that increasing the nanoplatelet aspect ratio or initial concentration in the filled layers would lead to even …
Fabrication And Characterization Of Graphene Based 2d Materials For Supercapacitors, Anishkumar Manoharan
Fabrication And Characterization Of Graphene Based 2d Materials For Supercapacitors, Anishkumar Manoharan
Graduate Theses and Dissertations
Supercapacitors have attracted a lot attention due to their efficient energy storage. In comparison to batteries, supercapacitors have high capacitance, energy, and power densities per unit mass than conventional capacitors. Carbon based materials are most promising in supercapacitor application due to their outstanding physical and electrochemical behavior. In this work, a facile method to synthesize a nanocomposite electrode consisting of annealed carbon from carbon ink and MoS2 was demonstrated. Effects of various aqueous and solid electrolytes were studied. It was found that the nanocomposite electrode with 10% MoS2 and 1M Na2SO4 as the aqueous electrolyte tested using the three electrode …
Surfactant Driven Assembly Of Freeze-Casted, Polymer-Derived Ceramic Nanoparticles On Grapehene Oxide Sheets For Lithium-Ion Battery Anodes, Ali Zein Khater
Surfactant Driven Assembly Of Freeze-Casted, Polymer-Derived Ceramic Nanoparticles On Grapehene Oxide Sheets For Lithium-Ion Battery Anodes, Ali Zein Khater
Honors Undergraduate Theses
Traditional Lithium-Ion Batteries (LIBs) are a reliable and cost-efficient choice for energy storage. LIBs offer high energy density and low self-discharge. Recent developments in electric-based technologies push for replacing historically used Lead-Acid batteries with LIBs. However, LIBs do not yet meet the demands of modern technology. Silicon and graphene oxide (GO) have been identified as promising replacements to improve anode materials. Graphene oxide has a unique sheet-like structure that provides a mechanically stable, light weight material for LIB anodes. Due to its structure, reduced graphene oxide (rGO) is efficiently conductive and resistive to environmental changes. On the other hand, silicon-based …
Synthesis Of Graphene And Graphene-Based Composite Membrane, Yuanjun Fan
Synthesis Of Graphene And Graphene-Based Composite Membrane, Yuanjun Fan
Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research
Vibration membrane equipped for earphone requires high performance in both mechanical properties and electronic properties. With extraordinary properties on both, graphene and graphene-based composite materials appear as a promising candidate for this application. Chemical vapor deposition (CVD) is believed to be the most convenient way to synthesize a large area (on scale of square centimeters) as well as a homogeneous thickness for the membrane. The thesis focuses on applying control variable experiment method to analyze different effects on mechanical property of the two CVD setting parameters: cooling rate, and hydrocarbon precursor. For isolating the specimens efficiently, a modified electrochemical method …
Two Dimensional Layered Materials And Heterostructures, A Surface Science Investigation And Characterization, Yujing Ma
USF Tampa Graduate Theses and Dissertations
The isolation of single layers of van der Waals materials has shown that their properties can be significantly different compared to their bulk counterparts. These observations, illustrates the importance of interface interactions for determining the materials properties even in weakly interacting materials and raise the question if materials properties of single layer van der Waals materials can be controlled by appropriate hetero-interfaces. To study interface effects in monolayer systems, surface science techniques, such as photoemission spectroscopy and scanning probe microscopy/spectroscopy, are ideally suited. However, before these characterization methods can be employed, approaches for the synthesis of hetero-van der Waals systems …
Graphite And Graphene-Oxide Based Pgm-Free Model Catalysts For The Oxygen Reduction Reaction, Joseph Henry Dumont
Graphite And Graphene-Oxide Based Pgm-Free Model Catalysts For The Oxygen Reduction Reaction, Joseph Henry Dumont
Nanoscience and Microsystems ETDs
The world currently relies heavily on fossil fuels such as coal, oil, and natural gas for its energy. Fossil fuels are non-renewable, that is, they draw on finite resources that will eventually dwindle, becoming too expensive or too environmentally damaging to retrieve. One alternative source of energy are fuel cells, electrochemical devices that convert chemical energy to cleanly and efficiently produce electricity. They can be used in a wide range of applications, including transportation, stationary, portable and emergency power sources. Their development has been slowed by the high cost of PGM electrocatalysts needed at both electrodes as well as sluggish …
Advanced Carbon Materials Based Electrodes For High Performance Symmetric Supercapacitors, Keliang Wang
Advanced Carbon Materials Based Electrodes For High Performance Symmetric Supercapacitors, Keliang Wang
Electronic Theses and Dissertations
Supercapacitors have received considerable attention due to their high energy density, long life time, rapid charge/discharge rate, and because they are environmental friendly technology. Electrode materials play a key role in the final performance of supercapacitors. Carbon, usually used as symmetric supercapacitors electrode materials, exhibit extraordinary stability in harsh electrolyte and electrochemical performance owing to its physical and chemical properties. In addition, porous structure originated from activation, excellent electrical conductivity, sustainability, wide availability and low cost further offering the improvement in electrochemical performance and make it to be a promising electrode material for symmetric supercapacitors. Considering the factors affected electrochemical …
Dft Study Of Adsorption Of Trimetallic Endohedral Fullerenes On Graphene, Nakul Nitin Karle
Dft Study Of Adsorption Of Trimetallic Endohedral Fullerenes On Graphene, Nakul Nitin Karle
Open Access Theses & Dissertations
A density functional theory (DFT) study on the geometric and electronic structure of C60 and Sc3N@C80 along with their adsorption on pristine single layer graphene (SLG) is presented. C60 is found to adsorb in two nearly degenerate configurations: (i) with a pentagon facing the SLG, which is the most stable one, and (ii) with a hexagon facing the SLG in a face-to-face perfect alignment, rarely common in Ï?â??Ï? interactions, 0.06 eV higher in energy. The calculated binding energy of 0.76 eV, which includes dispersion effects, is in good agreement with previous theoretical and experimental reports. On the contrary, Sc3N@C80 adsorption …
Effect Of Interlayers On Mechanical Properties And Interfacial Stress Transfer Of 2d Layered Graphene-Polymer Nanocompsites, Colton C. Roach
Effect Of Interlayers On Mechanical Properties And Interfacial Stress Transfer Of 2d Layered Graphene-Polymer Nanocompsites, Colton C. Roach
Theses and Dissertations--Mechanical and Aerospace Engineering
Graphene, a monolayer of sp2-hybridized carbon atoms arranged in a two-dimensional (2D) lattice, is one of the most important 2D nanomaterials and has attracted tremendous attentions due to its unique geometric characteristics and exceptional mechanical properties. One of the most promising applications of this 2D nanomaterial is in polymer nanocomposites, in which the ultra-stiff, ultra-thin graphene layers function as reinforcement fillers. However, two significant questions remain to be answered: (1) whether the mechanical behaviors of 2D graphene reinforced nanocomposites can be analyzed by the convention composite theory, which is developed primarily for one-dimensional (1D) fiber-type of fillers, and …