Keyword TD-DFT calculations | Collection of Czechoslovak Chemical Communications

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TD-DFT calculations

Jean-Marie André*, Denis Jacquemin, Eric A. Perpete, Daniel P. Vercauteren and Valérie Wathelet
Assessment of the Accuracy of TD-DFT Absorption Spectra: Substituted Benzenes
2008, Vol. 73, Issue 6-7, pp. 898–908 [Abstract]