Optical absorption spectra calculated using linear-scaling density-functional theory :: SCD d'Orléans

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

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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محفوظ في:

التفاصيل البيبلوغرافية
المؤلف الرئيسي:	Ratcliff, Laura, 19..-
التنسيق:	Livre numérique
اللغة:	Anglais
منشور في:	Heidelberg : Springer International Publishing 2013. Cham : Springer Nature
سلاسل:	Springer Theses, Recognizing Outstanding Ph.D. Research
الوصول للمادة أونلاين:	Accès sur la plateforme de l'éditeur Accès sur la plateforme Istex Accès Université d'Orléans Accès INSA CVL
ملاحظة:	Archives Springer e-books (Licence nationale) Archives Springer e-books (Licence nationale)
Autres localisations:	Voir dans le Sudoc
Edition sous un autre format:	• Optical Absorption Spectra Calculated Using Linear-Scaling Density-Functional Theory, Texte imprimé, 9783319003382

مواد مشابهة

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Applications of Density Functional Theory to Chemical Reactivity
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Pseudosolution of Linear Functional Equations : Parameters Estimation of Linear Functional Relationships
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