[PDF.89he] Materials Modelling using Density Functional Theory: Properties and Predictions

Materials Modelling using Density Functional Theory: Properties and Predictions

[PDF.ch78] Materials Modelling using Density Functional Theory: Properties and Predictions

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 | #592163 in Books |  Oxford University Press UK |  2014-07-15 |  2014-07-15 | Original language:English | PDF # 1 |  6.70 x.60 x9.60l,.0 | File type: PDF | 304 pages

 | Oxford University Press UK

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||6 of 6 people found the following review helpful.| A Wonderful Book!|By MSE fanatic|This is an outstanding monograph on the background and use of density functional theory (DFT) in materials science. Dr. Feliciano Giustino has written a textbook that it is accessible to students in an undergraduate physics or a graduate physics/materials science program. However a dedicated and passionate undergraduate in chemistry or material| |The density functional theory has finally brought quantum mechanics into materials science. Its proven ability to produce correct predictions of properties of real materials means that it has taken over as the premier method in solid state materials, ultimatel

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,...

You can specify the type of files you want, for your device.Materials Modelling using Density Functional Theory: Properties and Predictions   |  Feliciano Giustino. Just read it with an open mind because none of us really know.

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