【作者】: Pople, J. A.; Scott, A. P.; Wong, M. W.; Radom, L. 【题名】:Scaling Factors for Obtaining Fundamental Vibrational Frequencies and Zero-Point Energies from HF/6-31G* and MP2/6-31G* Harmonic Frequencies 【期刊】: Isr. J. Chem. 【年、卷、期、起止页码】 1993, 33, 345. 【全文链接】: