Solvent effects within the CS INDO method. Geometrical distortion and solvatochromism of merocyanine dyes
Author:
Publisher
Elsevier BV
Subject
Physical and Theoretical Chemistry,General Physics and Astronomy
Reference38 articles.
1. A new INDO-type procedure for conjugated non-rogid molecules. II. Extension to electronic spectra and excited-state potential curves
2. Potential-energy curves of the torsional mode of 1,1′-binaphthyl in the ground and lowest excited singlet states. A CS–INDO/CI study
3. Rotamerism in 2,2′-binaphthyl. A study based on fluorescence analysis and CS-INDO/CI calculations
4. Rotational isomerism in trans-1,2-diarylethylenes
5. Theoretical study of trans-cis photoisomerism in polymethine cyanines
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1. Verdict: Time-Dependent Density Functional Theory “Not Guilty” of Large Errors for Cyanines;Journal of Chemical Theory and Computation;2012-03-14
2. Solvent Dependence of Structure, Charge Distribution, and Absorption Spectrum in the Photochromic Merocyanine−Spiropyran Pair;The Journal of Physical Chemistry B;2011-03-21
3. Electronic spectra and (hyper)polarizabilities of non-centrosymmetric D–A–D chromophores. An experimentally based three-state model and a theoretical TDDFT study of ketocyanines;Physical Chemistry Chemical Physics;2011
4. A Solution- and Solid-State Investigation of Medium Effects on Charge Separation in Metastable Photomerocyanines;Journal of the American Chemical Society;2010-08-23
5. Solvation in Pure Liquids: What Can Be Learned from the Use of Pairs of Indicators?;The Journal of Physical Chemistry B;2008-10-31
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