TD-DFT Performance for the Visible Absorption Spectra of Organic Dyes: Conventional versus Long-Range Hybrids.
By Denis Jacquemin, Eric A. Perpète, Gustavo E. Scuseria, Ilaria Ciofini, Carlo Adamo. Journal of Chemical Theory and Computation, 2008
793 citations recorded by the source corpus.
Subfields: Atomic and Molecular Physics, and Optics, Organic Chemistry, Physical and Theoretical Chemistry
View Paper: https://www.semanticscholar.org/paper/b55e5a8fb64cbea2e2d494d689ae2fb8eb62d4e8
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In Atomic and Molecular Physics, and Optics
In Organic Chemistry
In Physical and Theoretical Chemistry
Citations in the corpus
- Tuned range-separated hybrids in density functional theory. (2010, methodology): “We have thus identified two separate problems with the application of adiabatic linear response to CTEs for large R DA as described in Table 1.”