Optical absorption spectra calculated using linear-scaling density-functional theory

The development of linear-scaling density functional theory (LS-DFT) has made ab initio calculations on systems containing thousands of atoms possible. These systems range from nanostructures to biomolecules. These methods rely on the use of localized basis sets, which are optimised for the represen...

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Detaylı Bibliyografya
Yazar: Ratcliff, Laura, 19..-
Materyal Türü: Livre numérique
Dil:Anglais
Baskı/Yayın Bilgisi: Heidelberg : Springer International Publishing 2013.
Cham : Springer Nature
Seri Bilgileri:Springer Theses, Recognizing Outstanding Ph.D. Research
Online Erişim:Accès sur la plateforme de l'éditeur
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Not: Archives Springer e-books (Licence nationale)
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Edition sous un autre format:• Optical Absorption Spectra Calculated Using Linear-Scaling Density-Functional Theory, Texte imprimé, 9783319003382

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