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High hydrogen evolution activities of dual-metal atoms incorporated N-doped graphenes achieved by coordination regulation

High hydrogen evolution activities of dual-metal atoms incorporated N-doped graphenes achieved by coordination regulation PDF Author: Cunjin Zhang
Publisher: OAE Publishing Inc.
ISBN:
Category : Technology & Engineering
Languages : en
Pages : 14

Book Description
Electrolysis of water to produce hydrogen (H) can solve the current energy crisis and environmental problems. However, efficient hydrogen evolution reaction (HER) catalysts are still limited to a few noble metals, thus prohibiting their broad applications. Herein, first-principles calculations were carried out to investigate the theoretical HER performances of a series of N-doped graphenes containing inexpensive single- and dual-metal atoms. Among them, MN4-gra (M = Fe, Co, Ni), homonuclear MMN6-gra, and heteronuclear M1M2N6-gra mostly exhibit low HER activities due to the weak H adsorption, and only CoN4-gra, NiNiN6-gra, and CoNiN6-gra show better ΔG*H values of 0.19, 0.15 and 0.27 eV, respectively. In contrast, low-coordinated MMN5-gra and M1M2N5-gra both have rather high HER activities. In particular, the ΔG*H values of FeNiN5-gra and CoNiN5-gra are as low as -0.04 and -0.06 eV, respectively, very close to the ideal 0 eV. Detailed analyses reveal that such high activity mainly stems from the reduced metal coordination and the synergistic effect between the two metals, which greatly enhance the adsorption ability of the active center. More interestingly, the strong H adsorption of MMN5-gra/M1M2N5-gra could enable them to further adsorb a second H atom and generate a stable HMH intermediate to yield the final product H2. Under this novel mechanism, the two-step |ΔG*H| values of FeNiN5-gra and CoNiN5-gra are all no more than 0.10 eV. Our work not only discloses the important effect of coordination regulation and site synergy on enhancing the catalytic activity but also finds a new HER path on the metal-embedded N-doped graphenes.

High hydrogen evolution activities of dual-metal atoms incorporated N-doped graphenes achieved by coordination regulation

High hydrogen evolution activities of dual-metal atoms incorporated N-doped graphenes achieved by coordination regulation PDF Author: Cunjin Zhang
Publisher: OAE Publishing Inc.
ISBN:
Category : Technology & Engineering
Languages : en
Pages : 14

Book Description
Electrolysis of water to produce hydrogen (H) can solve the current energy crisis and environmental problems. However, efficient hydrogen evolution reaction (HER) catalysts are still limited to a few noble metals, thus prohibiting their broad applications. Herein, first-principles calculations were carried out to investigate the theoretical HER performances of a series of N-doped graphenes containing inexpensive single- and dual-metal atoms. Among them, MN4-gra (M = Fe, Co, Ni), homonuclear MMN6-gra, and heteronuclear M1M2N6-gra mostly exhibit low HER activities due to the weak H adsorption, and only CoN4-gra, NiNiN6-gra, and CoNiN6-gra show better ΔG*H values of 0.19, 0.15 and 0.27 eV, respectively. In contrast, low-coordinated MMN5-gra and M1M2N5-gra both have rather high HER activities. In particular, the ΔG*H values of FeNiN5-gra and CoNiN5-gra are as low as -0.04 and -0.06 eV, respectively, very close to the ideal 0 eV. Detailed analyses reveal that such high activity mainly stems from the reduced metal coordination and the synergistic effect between the two metals, which greatly enhance the adsorption ability of the active center. More interestingly, the strong H adsorption of MMN5-gra/M1M2N5-gra could enable them to further adsorb a second H atom and generate a stable HMH intermediate to yield the final product H2. Under this novel mechanism, the two-step |ΔG*H| values of FeNiN5-gra and CoNiN5-gra are all no more than 0.10 eV. Our work not only discloses the important effect of coordination regulation and site synergy on enhancing the catalytic activity but also finds a new HER path on the metal-embedded N-doped graphenes.

Carbon Nanotubes and Graphene

Carbon Nanotubes and Graphene PDF Author: Kazuyoshi Tanaka
Publisher: Newnes
ISBN: 0080982689
Category : Science
Languages : en
Pages : 458

Book Description
Carbon Nanotubes and Graphene is a timely second edition of the original Science and Technology of Carbon Nanotubes. Updated to include expanded coverage of the preparation, purification, structural characterization, and common application areas of single- and multi-walled CNT structures, this work compares, contrasts, and, where appropriate, unitizes CNT to graphene. This much expanded second edition reference supports knowledge discovery, production of impactful carbon research, encourages transition between research fields, and aids the formation of emergent applications. New chapters encompass recent developments in the theoretical treatments of electronic and vibrational structures, and magnetic, optical, and electrical solid-state properties, providing a vital base to research. Current and potential applications of both materials, including the prospect for large-scale synthesis of graphene, biological structures, and flexible electronics, are also critically discussed. - Updated discussion of properties, structure, and morphology of biological and flexible electronic applications aids fundamental knowledge discovery - Innovative parallel focus on nanotubes and graphene enables you to learn from the successes and failures of, respectively, mature and emergent partner research disciplines - High-quality figures and tables on physical and mathematical applications expertly summarize key information – essential if you need quick, critically relevant data

Advanced Heterogeneous Catalysts, Volume 1

Advanced Heterogeneous Catalysts, Volume 1 PDF Author: Sudarsanam Putla
Publisher: ACS Symposium
ISBN: 9780841298804
Category : Science
Languages : en
Pages : 608

Book Description
Advances and applications of nanosized catalysts Over the last five years, tremendous advances have been made in heterogeneous catalysis. In particular, catalysts' design from the bulk to nano-scale (1-100 nm), with desirable active sites, has received great attention in current catalysis research with the aim to fill the gap between homogeneous and heterogeneous catalysis. This volume focuses on applications of nanosized catalysts. Articles describe characterization, synthesis, and applications in biomass conversion, auto-exhaust purification, selective oxidation/hydrogenation, syngas conversion, and other important reactions. Readers will find examples of catalysts designed to be tunable for specific outcomes, inspiring their research. Scientists and engineers in chemistry, materials science, nanotechnology, and chemical engineering will find this volume useful.

Graphene

Graphene PDF Author: Wonbong Choi
Publisher: CRC Press
ISBN: 1439861889
Category : Science
Languages : en
Pages : 374

Book Description
Since the late 20th century, graphene-a one-atom-thick planar sheet of sp2-bonded carbon atoms densely packed in a honeycomb crystal lattice-has garnered appreciable attention as a potential next-generation electronic material due to its exceptional properties. These properties include high current density, ballistic transport, chemical inertness,

Carbon Nanowalls

Carbon Nanowalls PDF Author: Mineo Hiramatsu
Publisher: Springer Science & Business Media
ISBN: 3211997180
Category : Technology & Engineering
Languages : en
Pages : 168

Book Description
Representing the first text to cover this exciting new area of research, this book will describe synthesis techniques of CNWs, their characterization and various expected applications using CNWs. Carbon-nanowalls (CNWs) can be described as two-dimensional graphite nanostructures with edges comprised of stacks of plane graphene sheets standing almost vertically on the substrate. These sheets form a wall structure with a high aspect ratio. The thickness of CNWs ranges from a few nm to a few tens of nm. The large surface area and sharp edges of CNWs may prove useful for a number of applications such as electrochemical devices, field electron emitters, storage materials for hydrogen gas, catalyst support. In particular, vertically standing CNWs with a high surface-to-volume ratio, serve as an ideal material for catalyst support for fuel cells and in gas storage materials.

Defects in Two-Dimensional Materials

Defects in Two-Dimensional Materials PDF Author: Rafik Addou
Publisher: Elsevier
ISBN: 032390310X
Category : Technology & Engineering
Languages : en
Pages : 434

Book Description
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

Supported Metal Single Atom Catalysis

Supported Metal Single Atom Catalysis PDF Author: Philippe Serp
Publisher: Wiley-VCH
ISBN: 9783527348442
Category : Technology & Engineering
Languages : en
Pages : 688

Book Description
b”Supported Metal Single Atom CatalysisCovers all key aspects of supported metal single atom catalysts, an invaluable resource for academic researchers and industry professionals alike Single atom catalysis is one of the most innovative and dynamic research areas in catalysis science. Supported metal catalysts are used extensively across the chemical industry, ranging from fine and bulk chemical production to petrochemicals. Single atom catalysts (SACs) combine the advantages of both homogeneous and heterogeneous catalysts such as catalyst stability, activity, and high dispersion of the active phase. Supported Metal Single Atom Catalysis provides an authoritative and up-to-date overview of the emerging field, covering the synthesis, preparation, characterization, modeling, and applications of SACs. This comprehensive volume introduces the basic principles of single atom catalysis, describes metal oxide and carbon support materials for SAC preparation, presents characterization techniques and theoretical calculations, and discusses SACs in areas including selective hydrogenation, oxidation reactions, activation of small molecules, C-C bond formation, and biomedical applications. Highlights the activity, selectivity, and stability advantages of supported metal SACs compared to other heterogeneous catalysts Covers applications of SACs in thermal catalysis, electrocatalysis, and photocatalysis Includes chapters on single atom alloys and supported double and triple metal atom catalysts Discusses the prospects, challenges, and potential industrial applications of SACs Supported Metal Single Atom Catalysis is an indispensable reference for all those working in the fields of catalysis, solid-state chemistry, materials science, and spectroscopy, including catalytic chemists, organic chemists, electrochemists, theoretical chemists, and industrial chemists.

Atomic Layer Deposition for Semiconductors

Atomic Layer Deposition for Semiconductors PDF Author: Cheol Seong Hwang
Publisher: Springer Science & Business Media
ISBN: 146148054X
Category : Science
Languages : en
Pages : 266

Book Description
Offering thorough coverage of atomic layer deposition (ALD), this book moves from basic chemistry of ALD and modeling of processes to examine ALD in memory, logic devices and machines. Reviews history, operating principles and ALD processes for each device.

Nanomaterials for Electrocatalysis

Nanomaterials for Electrocatalysis PDF Author: Thandavarayan Maiyalagan
Publisher: Elsevier
ISBN: 0323857108
Category : Technology & Engineering
Languages : en
Pages : 400

Book Description
Nanomaterials for Electrocatalysis provides an overview of the different types of nanomaterials, design principles and synthesis protocols used for electrocatalytic reactions. The book is divided into four parts that thoroughly describe basic principles and fundamental of electrocatalysis, different types of nanomaterials used, and their electrocatalytic applications, limitations and future perspectives. As electrochemical systems containing nanomaterials, with relevance to experimental situation, yield better results, this book highlights new information and findings. Provides an overview of nanomaterials applications for electrocatalytic processes, such as oxygen reduction reaction (ORR), oxygen evolution reaction (OER), hydrogen evolution reaction (HER) and CO2 reduction reaction (CO2RR) Provides information on the design and development of various nanomaterials appropriate for electrocatalytic applications Assesses the challenges of manufacturing nanomaterials at an industrial scale for electronic applications

Two Dimensional Transition Metal Dichalcogenides

Two Dimensional Transition Metal Dichalcogenides PDF Author: Narayanasamy Sabari Arul
Publisher: Springer
ISBN: 9811390452
Category : Technology & Engineering
Languages : en
Pages : 361

Book Description
This book presents advanced synthesis techniques adopted to fabricate two-dimensional (2D) transition metal dichalcogenides (TMDs) materials with its enhanced properties towards their utilization in various applications such as, energy storage devices, photovoltaics, electrocatalysis, electronic devices, photocatalysts, sensing and biomedical applications. It provides detailed coverage on everything from the synthesis and properties to the applications and future prospects of research in 2D TMD nanomaterials.