Description

Book Synopsis

This book presents the first-principles calculations that can be used to determine the essential chemical and physical characteristics of cathode, electrolyte and anode materials in ion-based batteries. Methods for evaluating and analysing the first-principles results are discussed in detail, and the theoretical framework is illustrated for each system. This text is ideal as a reference for researchers and senior graduate students working on the theory and fundamental science of battery materials. It will also be useful for materials scientists and condensed matter physicists studying diverse crucial material properties.


Key Features:

?

  • Explores first-principles calculations that can be used to determine the essential chemical and physical characteristics of cathode, electrolyte and anode materials in ion-based batteries
  • Focuses on simulations and provides a theoretical framework for 3D m

FirstPrinciples Calculations for Cathode

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    Order before 4pm today for delivery by Wed 5 Aug 2026.

    A Hardback by Ming-Fa Lin, Ms Thi Dieu Hien Nguyen, Dr Shih-Yang Lin

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      Publisher: Institute of Physics Publishing
      Publication Date: Publication Date: 12/23/2021 12:00:00 AM
      ISBN13: 9780750346832, 978-0750346832
      ISBN10: 0750346833

      Description

      Book Synopsis

      This book presents the first-principles calculations that can be used to determine the essential chemical and physical characteristics of cathode, electrolyte and anode materials in ion-based batteries. Methods for evaluating and analysing the first-principles results are discussed in detail, and the theoretical framework is illustrated for each system. This text is ideal as a reference for researchers and senior graduate students working on the theory and fundamental science of battery materials. It will also be useful for materials scientists and condensed matter physicists studying diverse crucial material properties.


      Key Features:

      ?

      • Explores first-principles calculations that can be used to determine the essential chemical and physical characteristics of cathode, electrolyte and anode materials in ion-based batteries
      • Focuses on simulations and provides a theoretical framework for 3D m

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