Guang-Tao Yu

The nitrogen edge‐doped effect on the static first hyperpolarizability of the supershort single‐walled carbon nanotube

Di Wu, Wei Chen, Yuriko Aoki, 2009, J. Comput. Chem..

Evolution of lone pair of excess electrons inside molecular cages with the deformation of the cage in e2@C60F60 systems

Di Wu, Wei Chen, Zhi-Ru Li, 2011, J. Comput. Chem..

Theoretical study on nonlinear optical properties of the Li+[calix[4]pyrrole]Li−dimer, trimer and its polymer with diffuse excess electrons

Wei Chen, Feng Long Gu, Yuriko Aoki, 2009, J. Comput. Chem..