08 August 2019 6 3K Report

I am trying to work with some metal (Fe,Zn,Pb,Hg,Cd) complexes of Cysteine in Gaussian16. I tried B3LYP/6-311++G for Fe & Zn and B3LYP/LanL2DZ for other complexes. Am I in the right track? Again I am confused about using polarization functions for Fe and Zn complex. Can anyone suggest me with best ones?

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