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Journal Abstract Search

110 related items for PubMed ID: 31950958

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  • 23. Molecular and NLO Properties of Red Fluorescent Coumarins - DFT Computations Using Long-Range Separated and Conventional Functionals.
    Sekar N, Katariya S, Rhyman L, Alswaidan IA, Ramasami P.
    J Fluoresc; 2019 Jan; 29(1):241-253. PubMed ID: 30554293
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  • 24. Theoretical insights into UV-Vis absorption spectra of difluoroboron β-diketonates with an extended π system: An analysis based on DFT and TD-DFT calculations.
    Gelfand N, Freidzon A, Vovna V.
    Spectrochim Acta A Mol Biomol Spectrosc; 2019 Jun 05; 216():161-172. PubMed ID: 30897377
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  • 27. DFT and TD-DFT study on geometries, electronic structures and electronic absorption of some metal free dye sensitizers for dye sensitized solar cells.
    Mohr T, Aroulmoji V, Ravindran RS, Müller M, Ranjitha S, Rajarajan G, Anbarasan PM.
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan 25; 135():1066-73. PubMed ID: 25173523
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  • 28. Critical analysis of spectral solvent shifts calculated by the contemporary PCM approaches of a representative series of charge-transfer complexes between tetracyanoethylene and methylated benzenes.
    Budzák Š, Mach P, Medved' M, Kysel' O.
    Phys Chem Chem Phys; 2015 Jul 21; 17(27):17618-27. PubMed ID: 26051338
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  • 30. Pyrazolo[4,3-a]quinindoline as a new highly fluorescent heterocyclic system: Design, synthesis, spectroscopic characterization and DFT calculations.
    Alikhani E, Pordel M, Daghigh LR.
    Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb 05; 136 Pt C():1484-90. PubMed ID: 25459710
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  • 34. Electronic structure and solvatochromism of merocyanines NMR spectroscopic point of view.
    Kulinich AV, Ishchenko AA, Groth UM.
    Spectrochim Acta A Mol Biomol Spectrosc; 2007 Sep 05; 68(1):6-14. PubMed ID: 17188560
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  • 36. Choosing a Functional for Computing Absorption and Fluorescence Band Shapes with TD-DFT.
    Charaf-Eddin A, Planchat A, Mennucci B, Adamo C, Jacquemin D.
    J Chem Theory Comput; 2013 Jun 11; 9(6):2749-60. PubMed ID: 26583866
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  • 40. ExTTF-based dyes absorbing over the whole visible spectrum.
    Bouit PA, Villegas C, Delgado JL, Viruela PM, Pou-Amérigo R, Ortí E, Martín N.
    Org Lett; 2011 Feb 18; 13(4):604-7. PubMed ID: 21214258
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