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[会议论文] 作者:Yibo Lei,Yubin Wang,Zhenyi Wen,Bingbing Suo,
来源:The 15th ICQC International Congress of Quantum Chemistry(第1 年份:2015
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[会议论文] 作者:Yibo Lei,Bingbing Suo,Yubin Wang,Zhenyi Wen,
来源:The 15th ICQC International Congress of Quantum Chemistry(第1 年份:2015
A new internally contracted MRCI program has been recently implemented by our Xian-CI group based on Graphical Unitary Group Approach(GUGA) and hole-particle symmetry....
[会议论文] 作者:Yibo Lei,Yubin Wang,Huixian Han,Qi Song,Bingbing Suo,Zhenyi Wen,
来源:第六届全国物理无机化学会议 年份:2012
We present an improved version of the configuration-based multi-reference second-order perturbation approach (CB-MRPT2) according to the formulation of Lindgren on perturbation theory of a degenerate...
[会议论文] 作者:Huixian Han,Yubin Wang,Yibo Lei,Bingbing Suo,GaoHong Zhai,Zhenyi Wen,
来源:International Conference on Theoretical and High Performance 年份:2013
The typical test cases have been performed to assess the performance of the improved configuration-based multi-reference second order perturbation theory (CB-MRPT2).The test cases include double-bond...
Two Dimetallocenes with Vanadium and Chromium -Electronic Structures and Their Promising Application
[会议论文] 作者:Yong MENG,Ying HAN,Zhanying YANG,Kaiyuan SHEN,Bingbing SUO,Yibo LEI,Gaohong ZHAI,Zhenyi WEN,Haiyan ZHU,
来源:第十八届中国科协年会 年份:2016
As a clean energy,because of its environmental protection,large chemical energy,abundance and high efficiency,hydrogen energy is widely considered that it i...
Two Dimetallocenes with Vanadium and Chromium -Electronic Structures and Their Promising Application
[会议论文] 作者:Yong MENG,Ying HAN,Haiyan ZHU,Zhanying YANG,Kaiyuan SHEN,Bingbing SUO,Yibo LEI,Gaohong ZHAI,Zhenyi WEN,
来源:第十八届中国科协年会 年份:2016
As a clean energy,because of its environmental protection,large chemical energy,abundance and high efficiency,hydrogen energy is widely considered that it is hopeful to replace fossil energy and ease...
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