Shan Du

A MP2(full) and CCSD(T) theoretical investigation on the dihydrogen-bonded interactions between HNa and RBBH (R = F, Cl, H, CN, NC and CO)

Wenliang Wang, Fu-de Ren, Yan Li, 2011 .

A (U)MP2(full) and (U)CCSD(T) theoretical investigation into the substituent effects on the cation–π interactions between M+ (M = Li or Na) and LBBL (L = H, CH3, OH, CN, NC, F, :CO, :NN, :BH, :CN−, :NC− and :OH−)

Fu-de Ren, Yong Wang, Lin Zhang, 2011 .

A B3LYP and MP2(full) theoretical investigation into explosive sensitivity upon the formation of the molecule-cation interaction between the nitro group of 3,4-dinitropyrazole and H+, Li+, Na+, Be2+ or Mg2+

Yong Wang, Jianlong Wang, Shan Du, 2012, Journal of Molecular Modeling.

A (U)MP2(full) and (U)CCSD(T) theoretical investigation into the substituent effects on the intermolecular T-shaped F–H…π interactions between HF and LBBL (L = −H, ∶CO, :NN, –Cl, –CN and –NC)

Fu-de Ren, Lei Yang, Lin Zhang, 2012, Journal of Molecular Modeling.

3,4-Dinitro-1H-pyrazole benzene 0.25-solvate

Jianlong Wang, Yong-xiang Li, Shan Du, 2011, Acta crystallographica. Section E, Structure reports online.