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Theoretical Investigations Of Two Dimensional Materials


Theoretical Investigations Of Two Dimensional Materials
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Theoretical Investigations Of Two Dimensional Materials


Theoretical Investigations Of Two Dimensional Materials
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Author :
language : en
Publisher:
Release Date : 2020

Theoretical Investigations Of Two Dimensional Materials written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020 with categories.




Two Dimensional Semiconductors


Two Dimensional Semiconductors
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Author : Jingbo Li
language : en
Publisher: John Wiley & Sons
Release Date : 2020-02-26

Two Dimensional Semiconductors written by Jingbo Li and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2020-02-26 with Technology & Engineering categories.


In-depth overview of two-dimensional semiconductors from theoretical studies, properties to emerging applications! Two-dimensional (2D) materials have attracted enormous attention due to their exotic properties deriving from their ultrathin dimensions. 2D materials, such as graphene, transition metal dichalcogenides, transition metal oxides, black phosphorus and boron nitride, exhibit versatile optical, electronic, catalytic and mechanical properties, thus can be used in a wide range of applications, including electronics, optoelectronics and optical applications. Two-Dimensional Semiconductors: Synthesis, Physical Properties and Applications provides an in-depth view of 2D semiconductors from theoretical studies, properties to applications, taking into account the current state of research and development. It introduces various preparation methods and describes in detail the physical properties of 2D semiconductors including 2D alloys and heterostructures. The covered applications include, but are not limited to, field-effect transistors, spintronics, solar cells, photodetectors, light-emitting diode, sensors and bioelectronics. * Highly topical: 2D materials are a rapidly advancing field that attracts increasing attention * Concise overview: covers theoretical studies, preparation methods, physical properties, potential applications, the challenges and opportunities * Application oriented: focuses on 2D semiconductors that can be used in various applications such as field-effect transistors, solar cells, sensors and bioelectronics * Highly relevant: newcomers as well as experienced researchers in the field of 2D materials will benefit from this book Two-Dimensional Semiconductors: Synthesis, Physical Properties and Applications is written for materials scientists, semiconductor and solid state physicists, electrical engineers, and readers working in the semiconductor industry.



Growth Structure And Properties Of Selected Two Dimensional Materials From Density Functional Theory Investigations


Growth Structure And Properties Of Selected Two Dimensional Materials From Density Functional Theory Investigations
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Author : Abdulfattah Ab Abdulslam
language : en
Publisher:
Release Date : 2018

Growth Structure And Properties Of Selected Two Dimensional Materials From Density Functional Theory Investigations written by Abdulfattah Ab Abdulslam and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018 with Density functionals categories.




Fundamentals And Supercapacitor Applications Of 2d Materials


Fundamentals And Supercapacitor Applications Of 2d Materials
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Author : Chandra Sekhar Rout
language : en
Publisher: Elsevier
Release Date : 2021-05-04

Fundamentals And Supercapacitor Applications Of 2d Materials written by Chandra Sekhar Rout and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2021-05-04 with Technology & Engineering categories.


Fundamentals and Applications of Supercapacitor 2D Materials covers different aspects of supercapacitor 2D materials, including their important properties, synthesis, and recent developments in supercapacitor applications of engineered 2D materials. In addition, theoretical investigations and various types of supercapacitors based on 2D materials such as symmetric, asymmetric, flexible, and micro-supercapacitors are covered. This book is a useful resource for research scientists, engineers, and students in the fields of supercapacitors, 2D nanomaterials, and energy storage devices. Due to their sub-nanometer thickness, 2D materials have a high packing density, which is suitable for the fabrication of highly-packed energy supplier/storage devices with enhanced energy and power density. The flexibility of 2D materials, and their good mechanical properties and high packing densities, make them suitable for the development of thin, flexible, and wearable devices. Explores recent developments and looks at the importance of 2D materials in energy storage technologies Presents both the theoretical and DFT related studies Discusses the impact on performance of various operating conditions Includes a brief overview of the applications of supercapacitors in various industries, including aerospace, defense, biomedical, environmental, energy, and automotive



First Principles Studies Of Group Iv And Group V Related Two Dimensional Materials


First Principles Studies Of Group Iv And Group V Related Two Dimensional Materials
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Author :
language : en
Publisher:
Release Date : 2016

First Principles Studies Of Group Iv And Group V Related Two Dimensional Materials written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2016 with categories.


Abstract : Two dimensional (2D) materials have been extensively studied due to their novel properties and technologically important applications. Especially, the discovery of graphene has stimulated an avalanche of investigations to exploit its novel properties for applications at nanoscale. In the post-silicon era, graphene has been widely regarded as the most promising building blocks for the electronic devices. However, its metallic nature together with sensitivity to the environment leads to somewhat limited scope of applications. A finite band gap in a material is known to be essential for the fabrication of devices such as transistors. Such a limitation associated with graphene has led to the exploration of 2D materials beyond graphene. My work in this thesis can be broadly classified into two parts. The first part is focused on exploring the properties of some new 2D materials that have been synthesized in experiments using first-principles calculations based on density functional theory. Specifically, the electronic properties of group IV monolayer graphyne and group V monolayer phosphorene, engineering of their properties with external strain and defects, and the oxidation and degradation of phosphorene in air are investigated. The second part is focused on computational design of new 2D materials that have not been synthesized in experiments yet. For example, the structure and stability of antimonene and carbon phosphide monolayers are studied. These theoretical investigations in the present thesis not only improve our understandings on the physics and chemistry of existing 2D materials, but also lead to the fabrication of novel 2D materials for future applications.



Theoretical Investigation And Application Of Transonic Similarity Law For Two Dimensional Flow


Theoretical Investigation And Application Of Transonic Similarity Law For Two Dimensional Flow
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Author : William Perl
language : en
Publisher:
Release Date : 1950

Theoretical Investigation And Application Of Transonic Similarity Law For Two Dimensional Flow written by William Perl and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 1950 with Air flow categories.


The transonic similarity law for two-dimensional flow derived by von Karman was investigated by an iteration procedure similar to that of the Rayleigh-Janzen and Ackeret-Prandtl-Glauert methods. The results, which show that the potential can be expressed as a power series in a single parameter that depends on Mach number, thickness ratio, and ratio of specific heats, are in agreement with those of von Karman. By the iteration procedure, the second approximation for the flow past a Kaplan section was obtained in similarity form. The exact solution by Kaplan for the second approximation was examined and found expressible in the same similarity form. The exact numerical results to three approximations obtained by Kaplan for the Kaplan section and the circular arc have been reduced to transonic similarity form.



Two Dimensional Transition Metal Dichalcogenides


Two Dimensional Transition Metal Dichalcogenides
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Author : Chi Sin Tang
language : en
Publisher: John Wiley & Sons
Release Date : 2023-11-14

Two Dimensional Transition Metal Dichalcogenides written by Chi Sin Tang and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2023-11-14 with Technology & Engineering categories.


Two-Dimensional Transition-Metal Dichalcogenides Comprehensive resource covering rapid scientific and technological development of polymorphic two-dimensional transition-metal dichalcogenides (2D-TMDs) over a range of disciplines and applications Two-Dimensional Transition-Metal Dichalcogenides: Phase Engineering and Applications in Electronics and Optoelectronics provides a discussion on the history of phase engineering in 2D-TMDs as well as an in-depth treatment on the structural and electronic properties of 2D-TMDs in their respective polymorphic structures. The text addresses different forms of in-situ synthesis, phase transformation, and characterization methods for 2D-TMD materials and provides a comprehensive treatment of both the theoretical and experimental studies that have been conducted on 2D-TMDs in their respective phases. Two-Dimensional Transition-Metal Dichalcogenides includes further information on: Thermoelectric, fundamental spin-orbit structures, Weyl semi-metallic, and superconductive and related ferromagnetic properties that 2D-TMD materials possess Existing and prospective applications of 2D-TMDs in the field of electronics and optoelectronics as well as clean energy, catalysis, and memristors Magnetism and spin structures of polymorphic 2D-TMDs and further considerations on the challenges confronting the utilization of TMD-based systems Recent progress of mechanical exfoliation and the application in the study of 2D materials and other modern opportunities for progress in the field Two-Dimensional Transition-Metal Dichalcogenides provides in-depth review introducing the electronic properties of two-dimensional transition-metal dichalcogenides with updates to the phase engineering transition strategies and a diverse range of arising applications, making it an essential resource for scientists, chemists, physicists, and engineers across a wide range of disciplines.



Theoretical Investigation On Optical Properties Of 2d Materials And Mechanical Properties Of Polymer Composites At Molecular Level


Theoretical Investigation On Optical Properties Of 2d Materials And Mechanical Properties Of Polymer Composites At Molecular Level
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Author :
language : en
Publisher:
Release Date : 2022

Theoretical Investigation On Optical Properties Of 2d Materials And Mechanical Properties Of Polymer Composites At Molecular Level written by and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2022 with categories.


Abstract : The field of two-dimensional (2D) layered materials provides a new platform for studying diverse physical phenomena that are scientifically interesting and relevant for technological applications. Theoretical predictions from atomically resolved computational simulations of 2D materials play a pivotal role in designing and advancing these developments. The focus of this thesis is 2D materials especially graphene and BN studied using density functional theory (DFT) and molecular dynamics (MD) simulations. In the first half of the thesis, the electronic structure and optical properties are discussed for graphene, antimonene, and borophene. It is found that the absorbance in (atomically flat) multilayer antimonene (group V) is comparable to or greater than that for multilayer borophene (group III) and graphene (group IV). The number of layers has a substantial impact on the electrical and optical properties of graphene, antimonene, and borophene. Unlike graphene and antimonene, however, multilayer ẟ6-borophene exhibits extremely anisotropic electrical and optical characteristics. Overall, our findings imply that multilayer graphene and antimonene are good optical absorbers, particularly in the infrared region of the spectrum, and could be employed as a coating to protect against mid-IR tunable lasers. However, borophene because of its high optical transparency and good metallicity, could be a promising choice for transparent conductive 2D materials with applications in photovoltaics, performance-controlled optoelectronic devices, and touch displays. Molecular-level simulations for monomers with graphene/BN were undertaken to relate the interfacial features with the corresponding mechanical response in terms of strain and stiffness. The results show that the nature of bonding at the interface determines the interaction strength between resin (or hardener) and graphene and that the mechanical response follows the hierarchical order of the interaction strength at the interface. In addition, the change in polarity from graphene to BN monolayer also leads to improved interfacial strength as well as increased transverse stiffness at the molecular level for both resins and hardeners. We have also studied the effect of BN reinforcement with representative cases of cyanate esters, epoxy, and bismaleimide (BMI) resins using molecular dynamics to characterize the bulk level properties of reinforcement/polymer interface. Calculations simulating pull-apart transverse tension experiments find that the non-fluorinated ester interface exhibits higher stiffness and toughness than the fluorinated interface. On the other hand, the epoxy/BN interface is predicted to have significantly lower toughness (or resistance to fracture) than the BMI/BN interface. BMI, thus, appears to be the polymer matrix of choice when considering the BN nanomaterials as reinforcement compared to either cyanate ester or epoxy polymers for structural applications. These results based on molecular simulations emphasize the need to use computational modeling to efficiently and accurately determine molecular-level polymer/surface combinations that yield optimal composite material mechanical performance. This is especially true when designing and developing high-performance composites with nanoscale reinforcement.



Defects In Two Dimensional Materials


Defects In Two Dimensional Materials
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Author : Rafik Addou
language : en
Publisher: Elsevier
Release Date : 2022-02-14

Defects In Two Dimensional Materials written by Rafik Addou and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2022-02-14 with Technology & Engineering categories.


Defects in Two-Dimensional Materials addresses the fundamental physics and chemistry of defects in 2D materials and their effects on physical, electrical and optical properties. The book explores 2D materials such as graphene, hexagonal boron nitride (h-BN) and transition metal dichalcogenides (TMD). This knowledge will enable scientists and engineers to tune 2D materials properties to meet specific application requirements. The book reviews the techniques to characterize 2D material defects and compares the defects present in the various 2D materials (e.g. graphene, h-BN, TMDs, phosphorene, silicene, etc.). As two-dimensional materials research and development is a fast-growing field that could lead to many industrial applications, the primary objective of this book is to review, discuss and present opportunities in controlling defects in these materials to improve device performance in general or use the defects in a controlled way for novel applications. Presents the theory, physics and chemistry of 2D materials Catalogues defects of 2D materials and their impacts on materials properties and performance Reviews methods to characterize, control and engineer defects in 2D materials



Two Dimensional Electronics Prospects And Challenges


Two Dimensional Electronics Prospects And Challenges
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Author : Frank Schwierz
language : en
Publisher: MDPI
Release Date : 2018-09-27

Two Dimensional Electronics Prospects And Challenges written by Frank Schwierz and has been published by MDPI this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-09-27 with Electrical engineering. Electronics. Nuclear engineering categories.


This book is a printed edition of the Special Issue "Two-Dimensional Electronics - Prospects and Challenges" that was published in Electronics