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[期刊论文] 作者:Shao Ju-Xiang,Cheng Xin-Lu,Ynag Xiang-Dong,He Bi, 来源:中国物理(英文版) 年份:2006
By using the density functional theory (B3LYP) and four highly accurate complete basis set (CBS-Q, CBS-QB3, CBS-Lq, and CBS-4M) ab initio methods, the X(C, N, O...
[期刊论文] 作者:SHAO Ju-Xiang,ZHU Zheng-He,CHENG Xin-Lu,YANG Xiang-Dong, 来源:中国物理快报(英文版) 年份:2007
The potential energy function of nitrogen dioxide with the C2v symmetry in the ground state is represented using the simplified Sorbie-Murrell many-body expansi...
[期刊论文] 作者:SHAO Ju-Xiang,CHENG Xin-Lu,YANG Xiang-Dong,XIANG Shi-Kai, 来源:中国物理快报(英文版) 年份:2006
Bond dissociation energies for removal of nitrogen dioxide groups in 10 aliphatic nitro compounds, including nitromethane, nitroethylene, nitroethane, dinitrome...
[期刊论文] 作者:ZENG Zhi-Qiang,HOU Bang-Pin,LIU Fu-Ti,SHAO Ju-Xiang, 来源:中国物理快报(英文版) 年份:2014
A three-level ladder-type system with vacuum-induced coherence and incoherent pumping is studied to obtain a high refractive index without absorption.It is show...
[期刊论文] 作者:Shao Ju-Xiang,Zhu Zheng-He,Huang Duo-Hui,Wang Jun,Cheng Xin-Lu,Yang Xiang-Dong, 来源:中国物理(英文版) 年份:2007
Equilibrium parameters of ozone, such as equilibrium geometry structure parameters, force constants and dissociation energy are presented by CBS-Q ab initio cal...
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