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Recent Developments and Applications of Modern Density Functional Theory, Volume 4

Posted on 2010-05-24




Name:Recent Developments and Applications of Modern Density Functional Theory, Volume 4
ASIN/ISBN:0444824049
File size:53.6 Mb
Publisher: Elsevier Science
Publish Date: 1996-12-02
ISBN: 0444824049
File Type: PDF
Pages: 862 pages
File Size: 53.60 MB
   Recent Developments and Applications of Modern Density Functional Theory, Volume 4

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The present status of Density Functional Theory (DFT), which has evolved as the main technique for the study of matter at the atomistic level, is described in this volume. Knowing the behavior of atoms and molecules provides a sure avenue for the design of new materials with specific features and properties in many areas of science and technology. A technique based on purely first principles allowing large savings in time and money greatly benefits the specialist or designer of new materials.

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