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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| Format: | eBook |
| Language: | English |
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Heidelberg
Springer International Publishing
2013.
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| Series: | Springer Theses, Recognizing Outstanding Ph.D. Research
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| Online Access: | Click here to view the full text content |
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