完全活性空间组态相互作用能量的拟合和外推
曹静思,陈飞武
Fitting and Extrapolation of Configuration Interaction Energies in Complete Active Space
Jing-Si CAO,Fei-Wu CHEN
物理化学学报 . 2017, (6): 1130 -1139 .  DOI: 10.3866/PKU.WHXB201703221