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Zhi-Ru Li

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Journal Articles

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2011
[j7]
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  - journals/jcc/WangCYLWS11
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  - https://dblp.org/rec/journals/jcc/WangCYLWS11
Yin-Feng Wang, Wei Chen, Guang-Tao Yu, Zhi-Ru Li, Di Wu, Chia-Chung Sun:
Evolution of lone pair of excess electrons inside molecular cages with the deformation of the cage in e₂@C₆₀F₆₀ systems. J. Comput. Chem. 32(9): 2012-2021 (2011)
2010
[j6]
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Yin-Feng Wang, Zhi-Ru Li, Di Wu, Chia-Chung Sun, Feng Long Gu:
Excess electron is trapped in a large single molecular cage C₆₀F₆₀. J. Comput. Chem. 31(1): 195-203 (2010)
[j5]
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Bing-Qiang Wang, Fang-Fang Wang, Fang Ma, Zhi-Ru Li, Di Wu, Hong-Liang Xu, Feng Long Gu:
Intermolecular covalent interaction: 20-center-2-electron covalent π/π bonding in tetrathiafulvalene radical-cation dimer TTF·⁺-TTF·⁺. J. Comput. Methods Sci. Eng. 10(3-6): 357-366 (2010)
2009
[j4]
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Hong-Liang Xu, Fang-Fang Wang, Zhi-Ru Li, Bing-Qiang Wang, Di Wu, Wei Chen, Guang-Tao Yu, Feng Long Gu, Yuriko Aoki:
The nitrogen edge-doped effect on the static first hyperpolarizability of the supershort single-walled carbon nanotube. J. Comput. Chem. 30(7): 1128-1134 (2009)
2007
[j3]
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Ying Li, Di Wu, Zhi-Ru Li, Chia-Chung Sun:
Structural and electronic properties of boron-doped lithium clusters: Ab initio and DFT studies. J. Comput. Chem. 28(10): 1677-1684 (2007)
2006
[j2]
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Zhi-Ru Li, Fang-Fang Wang, Di Wu, Ying Li, Wei Chen, Xiao-Ying Sun, Feng Long Gu, Yuriko Aoki:
Royal crown-shaped electride Li3-N3-Be containing two superatoms: New knowledge on aromaticity. J. Comput. Chem. 27(8): 986-993 (2006)
2004
[j1]
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  - journals/jcmse/WuLDZZWH04
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Di Wu, Zhi-Ru Li, Yi-Hong Ding, Man Zhang, Zhi-Ren Zheng, Bing-Qiang Wang, Xi-Yun Hao:
Ab initio determination of the interaction hyperpolarizability for the H-bond complex NH_3-HF. J. Comput. Methods Sci. Eng. 4(3): 301-306 (2004)

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