Shuhua Li*, Jing Ma, and Yuansheng Jiang "Pair-correlated coupled cluster theory: An alternative multireference coupled cluster method" J. Chem. Phys. 118, 5736(2003)   PDF

Ganbing Zhang, Shuhua Li* and Yuansheng Jiang "Substituent effect of the spin-coupling constant through m-phenylene in m-xylylene and its derivatives" Tetrahedron 59, 3499 (2003)   PDF

Hui Chen, Shuhua Li*, and Yuansheng Jiang "A density functional theory study on the intramolecular proton transfer in the enzyme carbonic anhydrase" J. Phys. Chem. A. 107, 4652 (2003)   PDF

Ganbing Zhang, Shuhua Li*, and Yuansheng Jiang "Effects of substitution on the singlet-triplet energy splittings and ground-state multiplicities of m-phenylene-based diradicals: A density functional theory study" J. Phys. Chem. A. 107, 5573 (2003)   PDF

Jing Ma*, Shuhua Li, Chungen Liu, Yuansheng Jiang "The valence bond calculations on conjugated hydrocarbons of medium to infinite sizes" J. Chin. Chem. Soc. 50, 717 (2003)   PDF

Ganbing Zhang, Shuhua Li*, and Yuansheng Jiang "Dehydrogenation of methane by gas-phase Os+: A density functional study" Organometallics, 22, 3820 (2003)   PDF

Shuhua Li*, Wei Li, Jing Ma "A quick estimate of the correlation energy for alkanes" Chin. J. Chem. 21, 1422 (2003)   PDF