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Performance of DFT Methods in the Calculation of Optical Spectra of Chromophores
Performance of DFT Methods in the Calculation of Optical Spectra of Chromophores
2008
Jan Andzelm
Adam M. Rawlett
Joseph Dougherty
Niranjan Govind
Roi Baer
Keywords:
Correlation function
Chromophore
Spectral line
Chemistry
Density functional theory
Molecular physics
Correction
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