Theoretical study on the structures and stabilities of the isomers of N6H6
Fan, Jun-Jiao, Tan, Ying-Xiong, Li, Lai-Cai, Wang, Xin, Tian, An-Min, Wong, Ning-Bew
Published in Journal of molecular structure. Theochem (15.02.2008)
Published in Journal of molecular structure. Theochem (15.02.2008)
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Journal Article
An ab initio study of P–H⋯P interactions using the PH3⋯PH3 model complex
Wang, Weizhou, Zheng, Wenxu, Pu, Xuemei, Wong, Ning-Bew, Tian, Anmin
Published in Journal of molecular structure. Theochem (05.05.2003)
Published in Journal of molecular structure. Theochem (05.05.2003)
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Journal Article
Solvent-assisted catalysis mechanism on Keto–enol tautomerism of cyameluric acid
Liang, Xiaoqin, Zheng, Wenxu, Wong, Ning-Bew, Shu, Yuanjie, Tian, Anmin
Published in Journal of molecular structure. Theochem (01.11.2005)
Published in Journal of molecular structure. Theochem (01.11.2005)
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Journal Article
Computational studies on a kind of novel energetic materials tetrahedrane and nitro derivatives
Zhou, Ge, Zhang, Jing-Lai, Wong, Ning-Bew, Tian, Anmin
Published in Journal of molecular structure. Theochem (23.01.2004)
Published in Journal of molecular structure. Theochem (23.01.2004)
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Journal Article
Theoretical study on the cylinder-shaped N sub(78) cage
Zhou, Hongwei, Wong, Ning-Bew, Tian, Anmin
Published in Journal of molecular graphics & modelling (01.12.2006)
Published in Journal of molecular graphics & modelling (01.12.2006)
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Journal Article
Exploring the Reactivity Trends in the E2 and S N 2 Reactions of X − + CH 3 CH 2 Cl (X = F, Cl, Br, HO, HS, HSe, NH 2 PH 2 , AsH 2 , CH 3 , SiH 3 , and GeH 3 )
Wu, Xiao-Peng, Sun, Xiao-Ming, Wei, Xi-Guang, Ren, Yi, Wong, Ning-Bew, Li, Wai-Kee
Published in Journal of chemical theory and computation (09.06.2009)
Published in Journal of chemical theory and computation (09.06.2009)
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Journal Article
Discovery of Singlet Diradicals: Theoretical Study on the Cage Species C 14 N 12 −H 6 and Its Six Derivatives
Zhou, Hongwei, Wong, Ning-Bew, Lau, Kai-Chung, Tian, Anmin, Li, Wai-Kee
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (01.10.2007)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (01.10.2007)
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Journal Article
Intramolecular H-bonds in LLM-105 and its derivatives: a DFT study
He, Wen-Di, Zhou, Ge, Wong, Ning-Bew, Tian, An.-Min, Long, Xin-Ping
Published in Journal of molecular structure. Theochem (20.05.2005)
Published in Journal of molecular structure. Theochem (20.05.2005)
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Journal Article
Theoretical investigation of four conformations of HNIW by B3LYP method
Zhou, Ge, Wang, Jing, He, Wen-Di, Wong, Ning-Bew, Tian, Anmin, Li, Wai-Kee
Published in Journal of molecular structure. Theochem (16.08.2002)
Published in Journal of molecular structure. Theochem (16.08.2002)
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Journal Article
Theoretical study on the cylinder-shaped N 78 cage
Zhou, Hongwei, Wong, Ning-Bew, Tian, Anmin
Published in Journal of molecular graphics & modelling (2006)
Published in Journal of molecular graphics & modelling (2006)
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Journal Article
Theoretical study of the blue-shifting intramolecular hydrogen bonds of nitro derivatives of cubane
Zhou, Ge, Zhang, Jing-Lai, Wong, Ning-Bew, Tian, Anmin
Published in Journal of molecular structure. Theochem (03.11.2003)
Published in Journal of molecular structure. Theochem (03.11.2003)
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Journal Article
2006, Volume 110B Modeling of Hydrogen Bonds in Monohydrated 2,4-Dithiothymine: An Ab Initio and AIM Study
He, Wendi, Xue, Ying, Zhang, Hui, Tian, Anmin, Wong, Ning-Bew
Published in The journal of physical chemistry. B (18.05.2006)
Published in The journal of physical chemistry. B (18.05.2006)
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Journal Article
Tautomerism of monochalcogenosilanoic acids CH 3 Si(O)XH (X = S, Se, Te) in the gas phase and in the polar and aprotic solution: An ab initio computational investigation
Li, Qiang‐Gen, Deng, Chao, Ren, Yi, Wong, Ning‐Bew, Chu, San‐Yan, Wang, Xin
Published in International journal of quantum chemistry (01.01.2008)
Published in International journal of quantum chemistry (01.01.2008)
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Journal Article
A study on the reaction mechanism and kinetic of mercury oxidation by chlorine species
Li, Lai-Cai, Deng, Ping, Tian, An-Min, Xu, Ming-Hou, Zheng, Chu-Guang, Wong, Ning-Bew
Published in Journal of molecular structure. Theochem (05.05.2003)
Published in Journal of molecular structure. Theochem (05.05.2003)
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Journal Article
A theoretical study of the C–H⋯N hydrogen bond in the methane–ammonia complex
Wong, Ning-Bew, Cheung, Yu-San, Wu, D.Y, Ren, Y, Wang, X, Tian, A.M, Li, Wai-Kee
Published in Journal of molecular structure. Theochem (24.07.2000)
Published in Journal of molecular structure. Theochem (24.07.2000)
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Journal Article
Effect of CP-corrected gradient optimization on the water-radical (anion) dimmer hypersurface
Zheng, Wenxu, Wang, Weizhou, Pu, Xuemei, Tian, Anmin, Wong, Ning-Bew
Published in Journal of molecular structure. Theochem (01.08.2003)
Published in Journal of molecular structure. Theochem (01.08.2003)
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Journal Article
The gas-phase conformations of (N–Cl)-glycine: some theoretical observations
Pu, Xuemei, Wang, Weizhou, Zheng, Wenxu, Wong, Ning-Bew, Tian, Anmin
Published in Journal of molecular structure. Theochem (30.05.2003)
Published in Journal of molecular structure. Theochem (30.05.2003)
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Journal Article
Modeling of Hydrogen Bonds in Monohydrated 2,4-Dithiothymine: An Ab Initio and AIM Study
He, Wendi, Xue, Ying, Zhang, Hui, Tian, Anmin, Wong, Ning-Bow
Published in The journal of physical chemistry. B (26.01.2006)
Published in The journal of physical chemistry. B (26.01.2006)
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Journal Article
Syntheses of Ru–η 6-C 6H 6-diphosphine complexes and their catalytic properties for hydrogenation of benzene
Zhang, Li, Zhang, Yu, Zhou, Xiang-Ge, Li, Rui-Xiang, Li, Xian-Jun, Tin, Kim-Chung, Wong, Ning-Bew
Published in Journal of molecular catalysis. A, Chemical (2006)
Published in Journal of molecular catalysis. A, Chemical (2006)
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