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Study of Electronic Spectra of Free-Base Porphin and Mg-Porphin:Comprehensive Comparison of Variety of AbInitio, DFT and Semiempirical Methods

Publication at Faculty of Mathematics and Physics |
2004

Abstract

Study of Electronic Spectra of Free-Base Porphin and Mg-Porphin:Comprehensive Comparison of Variety of AbInitio, DFT and Semiempirical Methods