代表性研究成果 1、Aireti, M.; Jiang, Y.; Cao, H. B.; Duan, H. M.; Cui, X. H.; Jing, Q.; Xue, X., The cage-like structure enhanced magnetic moment in ScKn (n=2-12) clusters: A first-principles jointed particle swarm optimization investigation. Int J Quantum Chem 2021, 121 (14). 2、Liu, H. T.; Cao, H. B.; Cui, X. H. *(通讯作者); Duan, H. M.; Jing, Q.; Wang, Q., The geometry, electronic and magnetic properties of VLin(n =2-13) clusters using the first-principles and PSO method. Mol Phys 2020, 118 (24) 3、Li, L.; Cui, X. H. *(通讯作者); Cao, H. B.; Jiang, Y.; Duan, H. M.; Jing, Q.; Liu, J.; Wang, Q., Structural evolution and magnetic properties of ScLin( n=2-13) clusters: A PSO and DFT investigation. Chinese Phys B 2020, 29 (7), 077101/7. 4、Yang, G.; Cui, X. H. *(通讯作者), A first-principles investigation on the lone-pair enhanced birefringence and SHG response in K2SbF2Cl3. CHEMICAL RESEARCH 2020, 31 (05), 445-451. 5、Cui, X. H., Mu, B.X., Shen, Y.F., Dai, K., Vibrational relaxation and vibration-rotation energy transfer between highly vibrationally excited KH(X1Σ+, v=14–21) and CO2. Journal of Quantitative Spectroscopy and Radiative Transfer 2012, 113 (16), 2081-2087. 6、Cui, X. H., Mu, B.X., Shen, Y.F.,; Dai, K., Excitation Transfer for K2 in High-Lying States by N2. Chinese Physics Letters 2010, 27 (7). |