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[会议论文] 作者：Hui Li,Xiao-Yu Kuang,
来源：第五届全国计算原子与分子物理学术会议 年份：2014
The experimental free ion 4f12 energy levels for Yb4+ have been fitted to the standard f-shell free-ion Hamiltonian which includes the major electrostatic a...
[会议论文] 作者：Li-Ping Ding,Xiao-Yu Kuang,Peng Shao,
来源：第五届全国计算原子与分子物理学术会议 年份：2014
In order to explore new magnetic superhalogens,we have systematically investigated the structures,electrophilic properties,stabilities,magnetic properties a...
[期刊论文] 作者：Xi-Long Dou,Xiao-Yu Kuang,Xin-Xin Xia,Meng Ju,
来源：中国物理B（英文版） 年份：2019
The exploration of the appropriate red phosphor with good luminescence properties is an important issue in the de-velopment of current white light-emitting diod...
Structural stability and elastic properties of IrSi in B31 and B20-phase from first-principles calcu
[会议论文] 作者：Chuan-Zhao Zhang,Xiao-Yu Kuang,Yuan-Yuan Jin,Xiao-Zhen Yan,Xiao-FenHuang,
来源：第十八届全国原子与分子物理学术会议 年份：2015
...
Structural stability and elastic properties of IrSi in B31 and B20-phase from first-principles calcu
[会议论文] 作者：Chuan-Zhao Zhang,Xiao-Yu Kuang,Yuan-Yuan Jin,Xiao-Zhen Yan,Xiao-FenHuang,
来源：第十八届全国原子与分子物理学术会议 年份：2015
A systematic study of the structural stability,elastic properties and electronic structures for iridium silicide (IrSi) in B31 and B20-phase has been carried ou...
Pressure effect on the properties of magnetic moments and phase transitions in YMnO3 from first prin
[会议论文] 作者：Jun-Shuai Chai,Hao Tian,Ai-Jie Mao,Li-Juan Deng,Xiao-Yu Kuang,
来源：第六届全国计算原子与分子物理学术会议 年份：2016
...
[会议论文] 作者：Hao Tian,Xiao-Yu Kuang,Ai-Jie Mao,Hui Li,Fang-GuangKuang,Hong-Jian Zhao,
来源：第十八届全国原子与分子物理学术会议 年份：2015
...
[会议论文] 作者：Hao Tian,Xiao-Yu Kuang,Ai-Jie Mao,Hong-Jian Zhao,Hui Li,Fang-GuangKuang,
来源：第十八届全国原子与分子物理学术会议 年份：2015
First-principles calculations are performed to simulate hydrostatic pressure and misfit strain effect on PbNiO3 (PNO) material.Using Vienna ab initio Simulation Package (VASP) within the generalized g...
Study of the Structural and Electronic Properties of Neutral and Charged Niobium-Doped Silicon Clust
[会议论文] 作者：Xin-Xin Xia,Andreas Hermann,Xiao-Yu Kuang,Yuan-Yuan Jin,Cheng Lu,Xiao-Dong Xing,
来源：第六届全国计算原子与分子物理学术会议 年份：2016
...
[会议论文] 作者：Hao Tian,Ai-Jie Mao,Hong Jian Zhao,Yingqi Cui,Hui Li,Xiao-Yu Kuang,
来源：第六届全国计算原子与分子物理学术会议 年份：2016
...
[会议论文] 作者：Meng Ju,Xiao-Yu Kuang,Li-Ping Ding,Jing-Jing Wang,Yuan-Yuan Jin,Jian Lv,Cheng Lu,George Maroulis,
来源：第十八届全国原子与分子物理学术会议 年份：2015
...
[会议论文] 作者：Xin-Xin Xia,Xiao-Yu Kuang,Yuan-Yuan Jin,Jing-Jing Wang,Chuan-Zhao Zhang,Meng Ju,Xiao-Dong Xing,Cheng,
来源：第十八届全国原子与分子物理学术会议 年份：2015
...
Structure Assignment and Electronic properties of niobium-doped silicon NbSinQ (n=2-20;Q =0,±1) clus
[会议论文] 作者：Xin-Xin Xia,Xiao-Yu Kuang,Yuan-Yuan Jin,Cheng Lu,Jing-Jing Wang,Chuan-Zhao Zhang,Meng Ju,Xiao-Dong Xing,
来源：第十八届全国原子与分子物理学术会议 年份：2015
Elemental siliconhas attracted much attentiondue to the importance in the modem life.Free silicon isextensively used in the aluminium-casting,steel refining,and...
Determination of the microstructure,energy levels and magnetic dipole transition mechanism for Tm3+d
[会议论文] 作者：Meng Ju,Xiao-Yu Kuang,Cheng Lu,Hui Li,Jing-Jing Wang,Chuan-Zhao Zhang,Yong-Sheng Zhu,Yau-Yuen Yeung,
来源：第六届全国计算原子与分子物理学术会议 年份：2016
Yttrium aluminum borate(YAB)doped with rare-earth ions are promising materials for the infrared lasers and self-frequency summing laser systems [1,2].The stable crystal forms of YAB doped with rare-ea...
[会议论文] 作者：Meng Ju,Jian Lv,Xiao-Yu Kuang,Li-Ping Ding,Cheng Lu,Jing-Jing Wang,Yuan-Yuan Jin,George Maroulis,
来源：第十八届全国原子与分子物理学术会议 年份：2015
Iron oxide clusters and nanoparticles are of primary significance in a wide spectrum of subjects ranging from astrophysics and astrochemistry to nanomedicine and materials science [1,2].It is now fair...
Exploration of stable stoichiometries, physical properties and hardness in the Rh-Si system: A first
[会议论文] 作者：Jing-Jing Wang,Xiao-Yu Kuang,Yuan-Yuan Jin,Chuan-Zhao Zhang,Meng Ju,Andreas Hermann,Cheng Lu,Meng-Ting,
来源：第十八届全国原子与分子物理学术会议 年份：2015
...
Exploration of stable stoichiometries, physical properties and hardness in the Rh-Si system A first-
[会议论文] 作者：Jing-Jing Wang,Andreas Hermann,Xiao-Yu Kuang,Yuan-Yuan Jin,Cheng Lu,Chuan-Zhao Zhang,Meng Ju,Meng-Ting,
来源：第十八届全国原子与分子物理学术会议 年份：2015
Binary intermetallic compund of transition metals and silicon constitute an important and diverse family of inorganic solids.They have been extensively investig...
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