Materials Modelling Using Density Functional Theory

Materials Modelling Using Density Functional Theory
Author: Feliciano Giustino
Publisher: Oxford University Press, USA
Total Pages: 303
Release: 2014
Genre: Mathematics
ISBN: 0199662444


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The book explains the fundamental ideas of density functional theory, and how this theory can be used as a powerful method for explaining and even predicting the properties of materials with stunning accuracy.


Materials Modelling Using Density Functional Theory
Language: en
Pages: 303
Authors: Feliciano Giustino
Categories: Mathematics
Type: BOOK - Published: 2014 - Publisher: Oxford University Press, USA

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The book explains the fundamental ideas of density functional theory, and how this theory can be used as a powerful method for explaining and even predicting th
Density Functional Theory
Language: en
Pages: 252
Authors: David S. Sholl
Categories: Science
Type: BOOK - Published: 2011-09-20 - Publisher: John Wiley & Sons

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Demonstrates how anyone in math, science, and engineering can master DFT calculations Density functional theory (DFT) is one of the most frequently used computa
Handbook of Materials Modeling
Language: en
Pages: 2903
Authors: Sidney Yip
Categories: Science
Type: BOOK - Published: 2007-11-17 - Publisher: Springer Science & Business Media

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The first reference of its kind in the rapidly emerging field of computational approachs to materials research, this is a compendium of perspective-providing an
Heterogeneous Catalysts
Language: en
Pages: 768
Authors: Wey Yang Teoh
Categories: Technology & Engineering
Type: BOOK - Published: 2021-02-23 - Publisher: John Wiley & Sons

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Presents state-of-the-art knowledge of heterogeneous catalysts including new applications in energy and environmental fields This book focuses on emerging techn
Modeling Materials
Language: en
Pages: 789
Authors: Ellad B. Tadmor
Categories: Science
Type: BOOK - Published: 2011-11-24 - Publisher: Cambridge University Press

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Material properties emerge from phenomena on scales ranging from Angstroms to millimeters, and only a multiscale treatment can provide a complete understanding.