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Performance of Hybrid DFT Compared to MP2 Methods in Calculating NonLinear Optical Properties of Divinylpyrene Derivatives Molecules
Zouaoui-Rabah, Mourad, Sekkal-Rahal, Majda, Djilani-Kobibi, Fatna, Elhorri, Abdelkader M, Springborg, MichaelLanguage:
english
Journal:
The Journal of Physical Chemistry A
DOI:
10.1021/acs.jpca.6b08040
Date:
October, 2016
File:
PDF, 1.29 MB
english, 2016