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"Materials Modelling Using Density Functional Theory" was published by Oxford University Press, Incorporated in 2014 - Oxford and the language of the book is English.


“Materials Modelling Using Density Functional Theory” Metadata:

  • Title: ➤  Materials Modelling Using Density Functional Theory
  • Author:
  • Language: English
  • Publisher: ➤  Oxford University Press, Incorporated
  • Publish Date:
  • Publish Location: Oxford

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Edition Specifications:

  • Pagination: 303

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"Materials Modelling Using Density Functional Theory" Description:

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This book is an introduction to the quantum theory of materials and first-principles computational materials modelling. It explains how to use density functional theory as a practical tool for calculating the properties of materials without using any empirical parameters. The structural, mechanical, optical, electrical, and magnetic properties of materials are described within a single unified conceptual framework, rooted in the Schrodinger equation of quantum mechanics, and powered by density functional theory. This book is intended for senior undergraduate and first-year graduate students in

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