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Book Quantum Mechanics Studies of Fuel Cell Catalysts and Proton Conducting Ceramics with Validation by Experiment

Download or read book Quantum Mechanics Studies of Fuel Cell Catalysts and Proton Conducting Ceramics with Validation by Experiment written by Ho-Cheng Tsai and published by . This book was released on 2015 with total page 0 pages. Available in PDF, EPUB and Kindle. Book excerpt: (Cont.) In part II, we used QM calculations to study methane stream reforming on a Ni-alloy catalyst surfaces for solid oxide fuel cell (SOFC) application. SOFC has wide fuel adaptability but the coking and sulfur poisoning will reduce its stability. Experimental results suggested that the Ni4Fe alloy improves both its activity and stability compared to pure Ni. To understand the atomistic origin of this, we carried out QM calculations on surface segregation and found that the most stable configuration for Ni4Fe has a Fe atom distribution of (0%, 50%, 25%, 25%, 0%) starting at the bottom layer. We calculated that the binding of C atoms on the Ni4Fe surface is 142.9 Kcal/mol, which is about 10 Kcal/mol weaker compared to the pure Ni surface. This weaker C binding energy is expected to make coke formation less favorable, explaining why Ni4Fe has better coking resistance. This result confirms the experimental observation. The reaction energy barriers for CHx decomposition and C binding on various alloy surface, Ni4X (X=Fe, Co, Mn, and Mo), showed Ni4Fe, Ni4Co, and Fe4Mn all have better coking resistance than pure Ni, but that only Ni4Fe and Fe4Mn have (slightly) improved activity compared to pure Ni. In part III, we used QM to examine the proton transport in doped perovskite-ceramics. Here we used a 2x2x2 supercell of perovskite with composition Ba8X7M1(OH)1O23 where X=Ce or Zr and M=Y, Gd, or Dy. Thus in each case a 4+ X is replace by a 3+ M plus a proton on one O. Here we predicted the barriers for proton diffusion allowing both includes intra-octahedron and inter-octahedra proton transfer. Without any restriction, we only observed the inter-octahedra proton transfer with similar energy barrier as previous computational work but 0.2 eV higher than experimental result for Y doped zirconate. For one restriction in our calculations is that the Odonor-Oacceptor atoms were kept at fixed distances, we found that the barrier difference between cerates/zirconates with various dopants are only 0.02~0.03 eV. To fully address performance one would need to examine proton transfer at grain boundaries, which will require larger scale ReaxFF reactive dynamics for systems with millions of atoms. The QM calculations used here will be used to train the ReaxFF force field.

Book Proton Conducting Ceramics

Download or read book Proton Conducting Ceramics written by Mathieu Marrony and published by Pan Stanford. This book was released on 2015-11-30 with total page 550 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book proposes a wide overview of the research and development of proton-conducting solid oxide materials. It is the first to approach the topic on proton-conducting ceramics and presents analysis studies from the fundamental to the most promising applied domains. It describes theoretical studies to enhance understanding of proton-transport mechanisms through materials and focuses on the main families of materials referred in the literature, highlighting their structure and their electrical and physicochemical properties. It lists the various routes of synthesis and processing methods used to develop such materials and deals with their main performances and prospects with respect to electromotive force, electrochemical hydrogen transport, and reactors. The book will be helpful for students from academic sciences as well as industrials dealing with applications of such materials.

Book Fuel Cell Engineering

Download or read book Fuel Cell Engineering written by and published by Academic Press. This book was released on 2012-08-14 with total page 481 pages. Available in PDF, EPUB and Kindle. Book excerpt: Fuel cells are attractive electrochemical energy converters featuring potentially very high thermodynamic efficiency factors. The focus of this volume of Advances in Chemical Engineering is on quantitative approaches, particularly based on chemical engineering principles, to analyze, control and optimize the steady state and dynamic behavior of low and high temperature fuel cells (PEMFC, DMFC, SOFC) to be applied in mobile and stationary systems. - Updates and informs the reader on the latest research findings using original reviews - Written by leading industry experts and scholars - Reviews and analyzes developments in the field

Book Principles of Fuel Cells

Download or read book Principles of Fuel Cells written by Xianguo Li and published by CRC Press. This book was released on 2005-12-22 with total page 465 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book is engineering oriented and covers a large variety of topics ranging from fundamental principles to performance evaluation and applications. It is written systematically and completely on the subject with a summary of state-of-the-art fuel cell technology, filling the need for a timely resource. This is a unique book serving academic researchers, engineers, as well as people working in the fuel cell industry. It is also of substantial interest to students, engineers, and scientists in mechanical engineering, chemistry and chemical engineering, electrochemistry, materials science and engineering, power generation and propulsion systems, and automobile engineering.

Book Recent Trends in Fuel Cell Science and Technology

Download or read book Recent Trends in Fuel Cell Science and Technology written by S. Basu and published by Springer Science & Business Media. This book was released on 2007-10-20 with total page 383 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book covers all the proposed fuel cell systems including PEMFC, SOFC, PAFC, MCFC, regenerative fuel cells, direct alcohol fuel cells, and small fuel cells to replace batteries.

Book Hydrogen and Fuel Cells

Download or read book Hydrogen and Fuel Cells written by International Energy Agency and published by Simon and Schuster. This book was released on 2004 with total page 208 pages. Available in PDF, EPUB and Kindle. Book excerpt: Hydrogen and fuel cells are vital technologies to ensure a secure and CO2-free energy future. Their development will take decades of extensive public and private effort to achieve technology breakthroughs and commercial maturity. Government research programs are indispensable for catalyzing the development process. This report maps the IEA countries' current efforts to research, develop and deploy the interlocking elements that constitute a "hydrogen economy", including CO2 capture and storage when hydrogen is produced out of fossil fuels. It provides an overview of what is being done, and by whom, covering an extensive complexity of national government R & D programs. The survey highlights the potential for exploiting the benefits of the international cooperation. This book draws primarily upon information contributed by IEA governments. In virtually all the IEA countries, important R & D and policy efforts on hydrogen and fuel cells are in place and expanding. Some are fully-integrated, government-funded programs, some are a key element in an overall strategy spread among multiple public and private efforts. The large amount of information provided in this publication reflects the vast array of technologies and logistics required to build the "hydrogen economy."--Publisher description.

Book Fuel Cells

    Book Details:
  • Author : Supramaniam Srinivasan
  • Publisher : Springer Science & Business Media
  • Release : 2006-05-05
  • ISBN : 0387251162
  • Pages : 707 pages

Download or read book Fuel Cells written by Supramaniam Srinivasan and published by Springer Science & Business Media. This book was released on 2006-05-05 with total page 707 pages. Available in PDF, EPUB and Kindle. Book excerpt: This concise sourcebook of the electrochemical, engineering and economic principles involved in the development and commercialization of fuel cells offers a thorough review of applications and techno-economic assessment of fuel cell technologies, plus in-depth discussion of conventional and novel approaches for generating energy. Parts I and II explain basic and applied electrochemistry relevant to an understanding of fuel cells. Part III covers engineering and technology aspects. The book is useful for undergraduate and graduate students and scientists interested in fuel cells. Unlike any other current book on fuel cells, each chapter includes problems based on the discussions in the text.

Book PEM Fuel Cells

Download or read book PEM Fuel Cells written by Yun Wang and published by Momentum Press. This book was released on 2013-04-06 with total page 450 pages. Available in PDF, EPUB and Kindle. Book excerpt: Polymer Electrolyte Membrane (PEM) fuel cells convert chemical energy in hydrogen into electrical energy with water as the only by-product. Thus, PEM fuel cells hold great promise to reduce both pollutant emissions and dependency on fossil fuels, especially for transportation—passenger cars, utility vehicles, and buses—and small-scale stationary and portable power generators. But one of the greatest challenges to realizing the high efficiency and zero emissions potential of PEM fuel cells technology is heat and water management. This book provides an introduction to the essential concepts for effective thermal and water management in PEM fuel cells and an assessment on the current status of fundamental research in this field. The book offers you: • An overview of current energy and environmental challenges and their imperatives for the development of renewable energy resources, including discussion of the role of PEM fuel cells in addressing these issues; • Reviews of basic principles pertaining to PEM fuel cells, including thermodynamics, electrochemical reaction kinetics, flow, heat and mass transfer; and • Descriptions and discussions of water transport and management within a PEM fuel cell, including vapor- and liquid-phase water removal from the electrodes, the effects of two-phase flow, and solid water or ice dynamics and removal, particularly the specialized case of starting a PEM fuel cell at sub-freezing temperatures (cold start) and the various processes related to ice formation.

Book PEM Fuel Cell Modeling and Simulation Using Matlab

Download or read book PEM Fuel Cell Modeling and Simulation Using Matlab written by Colleen Spiegel and published by Elsevier. This book was released on 2011-08-29 with total page 454 pages. Available in PDF, EPUB and Kindle. Book excerpt: Although, the basic concept of a fuel cell is quite simple, creating new designs and optimizing their performance takes serious work and a mastery of several technical areas. PEM Fuel Cell Modeling and Simulation Using Matlab, provides design engineers and researchers with a valuable tool for understanding and overcoming barriers to designing and building the next generation of PEM Fuel Cells. With this book, engineers can test components and verify designs in the development phase, saving both time and money. Easy to read and understand, this book provides design and modelling tips for fuel cell components such as: modelling proton exchange structure, catalyst layers, gas diffusion, fuel distribution structures, fuel cell stacks and fuel cell plant. This book includes design advice and MATLAB and FEMLAB codes for Fuel Cell types such as: polymer electrolyte, direct methanol and solid oxide fuel cells. This book also includes types for one, two and three dimensional modeling and two-phase flow phenomena and microfluidics. *Modeling and design validation techniques *Covers most types of Fuel Cell including SOFC *MATLAB and FEMLAB modelling codes *Translates basic phenomena into mathematical equations

Book Fuel Cells I

    Book Details:
  • Author : Günther G. Scherer
  • Publisher : Springer Science & Business Media
  • Release : 2008-09-11
  • ISBN : 3540697551
  • Pages : 279 pages

Download or read book Fuel Cells I written by Günther G. Scherer and published by Springer Science & Business Media. This book was released on 2008-09-11 with total page 279 pages. Available in PDF, EPUB and Kindle. Book excerpt: See table of contents

Book Thermo fluid Dynamics of Two Phase Flow

Download or read book Thermo fluid Dynamics of Two Phase Flow written by Mamoru Ishii and published by Springer Science & Business Media. This book was released on 2006-09-28 with total page 462 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book has been written for graduate students, scientists and engineers who need in-depth theoretical foundations to solve two-phase problems in various technological systems. Based on extensive research experiences focused on the fundamental physics of two-phase flow, the authors present the detailed theoretical foundation of multi-phase flow thermo-fluid dynamics as they apply to a variety of scenarios, including nuclear reactor transient and accident analysis, energy systems, power generation systems and even space propulsion.

Book Hydrogen Technology

Download or read book Hydrogen Technology written by Aline Léon and published by Springer Science & Business Media. This book was released on 2008-07-18 with total page 680 pages. Available in PDF, EPUB and Kindle. Book excerpt: Aline Leon ́ In the last years, public attention was increasingly shifted by the media and world governmentsto the conceptsof saving energy,reducingpollution,protectingthe - vironment, and developing long-term energy supply solutions. In parallel, research funding relating to alternative fuels and energy carriers is increasing on both - tional and international levels. Why has future energy supply become such a matter of concern? The reasons are the problems created by the world’s current energy supply s- tem which is mainly based on fossil fuels. In fact, the energystored in hydrocarb- based solid, liquid, and gaseous fuels was, is, and will be widely consumed for internal combustion engine-based transportation, for electricity and heat generation in residential and industrial sectors, and for the production of fertilizers in agric- ture, as it is convenient, abundant, and cheap. However, such a widespread use of fossil fuels by a constantly growing world population (from 2. 3 billion in 1939 to 6. 5 billion in 2006) gives rise to the two problems of oil supply and environmental degradation. The problemrelated to oil supply is caused by the fact that fossil fuels are not - newable primary energy sources: This means that since the rst barrel of petroleum has been pumped out from the ground, we have been exhausting a heritage given by nature.

Book Mini Micro Fuel Cells

    Book Details:
  • Author : S. Kakaç
  • Publisher : Springer Science & Business Media
  • Release : 2008-04-10
  • ISBN : 1402082959
  • Pages : 436 pages

Download or read book Mini Micro Fuel Cells written by S. Kakaç and published by Springer Science & Business Media. This book was released on 2008-04-10 with total page 436 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume contains an archival record of the NATO Advanced Institute on Mini – Micro Fuel Cells – Fundamental and Applications held in Çesme – Izmir, Turkey, July 22–August 3, 2007. The ASIs are intended to be a high-level teaching activity in scientific and technical areas of current concern. In this volume, the reader may find interesting chapters on Mini- Micro Fuel Cells with fundamentals and applications. In recent years, fu- cell development, modeling and performance analysis has received much attention due to their potential for distributed power which is a critical issue for energy security and the environmental protection. Small fuel cells for portable applications are important for the security. The portable devices (many electronic and wireless) operated by fuel cells for providing all-day power, are very valuable for the security, for defense and in the war against terrorism. Many companies in NATO and non-NATO countries have concentrated to promote the fuel cell industry. Many universities with industrial partners committed to the idea of working together to develop fuel cells. As tech- logy advanced in the 1980s and beyond, many government organizations joined in spending money on fuel-cell research. In recent years, interest in using fuel cells to power portable electronic devices and other small equipment (cell phones, mobile phones, lab-tops, they are used as micro power source in biological applications) has increased partly due to the promise of fuel cells having higher energy density.

Book Solid Oxide Fuel Cells

Download or read book Solid Oxide Fuel Cells written by Bin Zhu and published by John Wiley & Sons. This book was released on 2020-06-02 with total page 486 pages. Available in PDF, EPUB and Kindle. Book excerpt: Presents innovative approaches towards affordable, highly efficient, and reliable sustainable energy systems Written by leading experts on the subject, this book provides not only a basic introduction and understanding of conventional fuel cell principle, but also an updated view of the most recent developments in this field. It focuses on the new energy conversion technologies based on both electrolyte and electrolyte-free fuel cells?from advanced novel ceria-based composite electrolyte low temperature solid oxide fuel cells to non-electrolyte fuel cells as advanced fuel-to-electricity conversion technology. Solid Oxide Fuel Cells: From Electrolyte-Based to Electrolyte-Free Devices is divided into three parts. Part I covers the latest developments of anode, electrolyte, and cathode materials as well as the SOFC technologies. Part II discusses the non-electrolyte or semiconductor-based membrane fuel cells. Part III focuses on engineering efforts on materials, technology, devices and stack developments, and looks at various applications and new opportunities of SOFC using both the electrolyte and non-electrolyte principles, including integrated fuel cell systems with electrolysis, solar energy, and more. -Offers knowledge on how to realize highly efficient fuel cells with novel device structures -Shows the opportunity to transform the future fuel cell markets and the possibility to commercialize fuel cells in an extended range of applications -Presents a unique collection of contributions on the development of solid oxide fuel cells from electrolyte based to non-electrolyte-based technology -Provides a more comprehensive understanding of the advances in fuel cells and bridges the knowledge from traditional SOFC to the new concept -Allows readers to track the development from the conventional SOFC to the non-electrolyte or single-component fuel cell Solid Oxide Fuel Cells: From Electrolyte-Based to Electrolyte-Free Devices will serve as an important reference work to students, scientists, engineers, researchers, and technology developers in the fuel cell field.

Book Polymer Electrolyte Fuel Cells

Download or read book Polymer Electrolyte Fuel Cells written by Alejandro A. Franco and published by CRC Press. This book was released on 2013-07-09 with total page 618 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book focuses on the recent research progress on the fundamental understanding of the materials degradation phenomena in PEFC, for automotive applications. On a multidisciplinary basis, through contributions of internationally recognized researchers in the field, this book provides a complete critical review on crucial scientific topics related to PEFC materials degradation, and ensures a strong balance between experimental and theoretical analysis and preparation techniques with several practical applications for both the research and the industrial communities.

Book Hydrogen Air PEM Fuel Cell

Download or read book Hydrogen Air PEM Fuel Cell written by Shiwen Tong and published by Walter de Gruyter GmbH & Co KG. This book was released on 2018-09-24 with total page 226 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book presents the modeling and control of hydrogen-air PEM fuel cells, including simultaneous estimation of the parameters and states, fuzzy cluster modeling, SPM-based predictive control and advanced fuzzy control. MATLAB/Simulink-based modeling and control programs are discussed in detail. With simulations and experiments, it is an essential reference for both scientists and industrial engineers.

Book Fuel Cell Engines

Download or read book Fuel Cell Engines written by Matthew M. Mench and published by John Wiley & Sons. This book was released on 2008-03-07 with total page 530 pages. Available in PDF, EPUB and Kindle. Book excerpt: Fuel Cell Engines is an introduction to the fundamental principles of electrochemistry, thermodynamics, kinetics, material science and transport applied specifically to fuel cells. It covers scientific fundamentals and provides a basic understanding that enables proper technical decision-making.