The computational density functional theory (DFT) investigating the CO gas adsorption on magnesium porphyrin nanorings (Mg4@PNR4)
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The decorated butadiyne-linked four porphyrin nanorings with four magnesium cations (Mg4@PNR4) represented a novel class of nanoscale molecules. This Mg4@PNR4 system could be considered as a high surface area with favorable chemical and physical properties whi... ...