LEADER 05085nam 22006855 450 001 9910253986303321 005 20200703041005.0 010 $a1-4471-5677-3 024 7 $a10.1007/978-1-4471-5677-2 035 $a(CKB)3710000000514089 035 $a(EBL)4092916 035 $a(SSID)ssj0001585423 035 $a(PQKBManifestationID)16263032 035 $a(PQKBTitleCode)TC0001585423 035 $a(PQKBWorkID)14865429 035 $a(PQKB)10945414 035 $a(DE-He213)978-1-4471-5677-2 035 $a(MiAaPQ)EBC4092916 035 $a(PPN)190535776 035 $a(EXLCZ)993710000000514089 100 $a20151112d2016 u| 0 101 0 $aeng 135 $aur|n|---||||| 181 $ctxt 182 $cc 183 $acr 200 10$aPhysical Multiscale Modeling and Numerical Simulation of Electrochemical Devices for Energy Conversion and Storage $eFrom Theory to Engineering to Practice /$fedited by Alejandro A. Franco, Marie Liesse Doublet, Wolfgang G. Bessler 205 $a1st ed. 2016. 210 1$aLondon :$cSpringer London :$cImprint: Springer,$d2016. 215 $a1 online resource (253 p.) 225 1 $aGreen Energy and Technology,$x1865-3529 300 $aDescription based upon print version of record. 311 $a1-4471-5676-5 320 $aIncludes bibliographical references at the end of each chapters. 327 $aAtomistic Modeling of Electrode Materials for Li-Ion Batteries: From Bulk to Interfaces -- Multi-scale simulation study of Pt-alloys degradation for fuel cells applications -- Molecular dynamics simulations of electrochemical energy storage devices -- Continuum, Macroscopic Modeling of Polymer-Electrolyte Fuel Cells -- Mathematical Modeling of aging of Li-ion batteries -- Fuel cells and batteries in silico experimentation through integrative Multiscale Modeling -- Cost Modeling and Valuation of Grid-scale Electrochemical Energy Storage Technologies. 330 $aThe aim of this book is to review innovative physical multiscale modeling methods which numerically simulate the structure and properties of electrochemical devices for energy storage and conversion. Written by world-class experts in the field, it revisits concepts, methodologies and approaches connecting ab initio with micro-, meso- and macro-scale modeling of components and cells. It also discusses the major scientific challenges of this field, such as that of lithium-ion batteries. This book demonstrates how fuel cells and batteries can be brought together to take advantage of well-established multi-scale physical modeling methodologies to advance research in this area. This book also highlights promising capabilities of such approaches for inexpensive virtual experimentation. In recent years, electrochemical systems such as polymer electrolyte membrane fuel cells, solid oxide fuel cells, water electrolyzers, lithium-ion batteries and supercapacitors have attracted much attention due to their potential for clean energy conversion and as storage devices. This has resulted in tremendous technological progress, such as the development of new electrolytes and new engineering designs of electrode structures. However, these technologies do not yet possess all the necessary characteristics, especially in terms of cost and durability, to compete within the most attractive markets. Physical multiscale modeling approaches bridge the gap between materials? atomistic and structural properties and the macroscopic behavior of a device. They play a crucial role in optimizing the materials and operation in real-life conditions, thereby enabling enhanced cell performance and durability at a reduced cost. This book provides a valuable resource for researchers, engineers and students interested in physical modelling, numerical simulation, electrochemistry and theoretical chemistry. 410 0$aGreen Energy and Technology,$x1865-3529 606 $aEnergy storage 606 $aEnergy harvesting 606 $aElectrochemistry 606 $aEnergy Storage$3https://scigraph.springernature.com/ontologies/product-market-codes/116000 606 $aEnergy Harvesting$3https://scigraph.springernature.com/ontologies/product-market-codes/117000 606 $aElectrochemistry$3https://scigraph.springernature.com/ontologies/product-market-codes/C21010 615 0$aEnergy storage. 615 0$aEnergy harvesting. 615 0$aElectrochemistry. 615 14$aEnergy Storage. 615 24$aEnergy Harvesting. 615 24$aElectrochemistry. 676 $a660.297 702 $aFranco$b Alejandro A$4edt$4http://id.loc.gov/vocabulary/relators/edt 702 $aDoublet$b Marie Liesse$4edt$4http://id.loc.gov/vocabulary/relators/edt 702 $aBessler$b Wolfgang G$4edt$4http://id.loc.gov/vocabulary/relators/edt 801 0$bMiAaPQ 801 1$bMiAaPQ 801 2$bMiAaPQ 906 $aBOOK 912 $a9910253986303321 996 $aPhysical Multiscale Modeling and Numerical Simulation of Electrochemical Devices for Energy Conversion and Storage$92294359 997 $aUNINA