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|a 1000048734
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|a 9783731504283
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|a Kühn, Michael
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| 245 |
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|a Zweikomponentige Methoden im Rahmen der zeitabhängigen Dichtefunktionaltheorie - Theorie, Implementierung und Anwendung
|h Elektronische Ressource
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| 260 |
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|b KIT Scientific Publishing
|c 2015
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| 300 |
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|a 1 electronic resource (215 p. p.)
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| 653 |
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|a Organic light-emitting diodes
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| 653 |
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|a MetallclusterSpin-orbit coupling
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| 653 |
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|a Zeitabhängige Dichtefunktionaltheorie
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| 653 |
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|a Time-dependent density functional theory
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| 653 |
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|a Organische Leuchtdioden
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| 653 |
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|a Chemistry / bicssc
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| 653 |
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|a Metal clusters
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| 653 |
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|a Spin-Bahn-Kopplung
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| 041 |
0 |
7 |
|a deu
|2 ISO 639-2
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| 989 |
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|b DOAB
|a Directory of Open Access Books
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| 500 |
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|a Creative Commons (cc), https://creativecommons.org/licenses/by-sa/4.0/
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| 024 |
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|a 10.5445/KSP/1000048734
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| 856 |
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|u https://directory.doabooks.org/handle/20.500.12854/62990
|z DOAB: description of the publication
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| 856 |
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|u https://www.ksp.kit.edu/9783731504283
|7 0
|x Verlag
|3 Volltext
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| 082 |
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|a 540
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| 520 |
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|a This book reports on the derivation, implementation and application of two-component methods in the framework of time-dependent density functional theory. These methods allow the calculation of electronic transitions as well as the calculation of the correlation contribution to the electronic ground-state energy (RPA) and to the orbital energies (GW) including spin-orbit coupling. The focus of the applications is put on organic light-emitting diodes and clusters of heavy metals.
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