Erratum:'Special stability of cationic MPb_(12)~+clusters and superalkali character of neutral MPb_(12)clusters (M=B,Al,Ga,In,and Tl)'[J.Chem.Phys.124,154313 (2006)]

摘要

As mentioned in our work,though both Pb_(12)~(2-)and Si_(12)~(2-)clusters have eight pi electrons,Pb_(12)~(2-)is aromatic (-19.1 ppm of NICS)while Si_(12)~(2-)is antiaromatic (56.4 ppm of NICS).To explain the difference between Pb_(12)~(2-)and Si_(12)~(2-)clusters,we analyzed the MO-NICS (at the center of cluster)of Pb_(12)~(2-)with NBO5.0,and compared to the MO-NICS(O)of Si_(12)~(2-)reported by King et al.However,there are some errors for the MO-NICS values of Pb_(12)~(2-)cluster in Fig.6,although the deviations of these values are small.The purpose of this erratum is to rectify them.