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TDDFT-SOS Studies on the Polarizabilities and Second-order Hyperpolarizabilities of Zn3O3 Ⅱ-Ⅵ Semico
[期刊论文] 作者:QIU Yong-Qing,LIU Yi-Chun,
来源:结构化学 年份:2004
The geometrical structure of semiconductor clusters including Zn3O3 was optimized by the DFT B3LYP method. With the same basis sets, dipole moments, polarizabil...
Effects of Electron Donor and Different Solvents on Polarizability and Second Hyperpolarizability of
[期刊论文] 作者:LIU Hai-bo,QIU Yong-qing,YANG,
来源:高等学校化学研究(英文版) 年份:2004
The polarizability(a)and second hyperpolarizability(γ)were systemically investigated for singlet diradical complex involving X(X=B,Al,Ga)atom.The results show...
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