Shu-Guang Wang

发表

Icon of chemistry: the periodic system of chemical elements in the new century.

W. Schwarz, Shu-Guang Wang, 2009, Angewandte Chemie.

Icon of Chemistry: The Periodic System of Chemical Elements in the New Century

W. Schwarz, Shu-Guang Wang, 2009 .

Asymptotic Stability of a Supercritical Planar Sheet with Coflow Gas

Shu-Guang Wang, Qingyan Fu, Run-ze Duan, 2014 .

The electronic configurations of LnX (Ln = La–Eu, X = O, S, Se, Te): A FON–DFT investigation

Wenchao Ji, Shu-Guang Wang, W. Xu, 2015 .

Some solved problems of the periodic system of chemical elements

W. Schwarz, Shu-Guang Wang, 2009 .

Density functional study of closed-shell attractions of X(AuL)2q (X = N, O, P, S, As, Se) systems

Shu-Guang Wang, H. Fang, 2006 .

Gold coated M@Au12 nano-particles: assessment of different quantum chemical density functional approaches

W. Schwarz, Shu-Guang Wang, Y. Qiu, 2004 .

Density functional study of MnX2 (X=F, Cl, Br, I)

Dongxue Chen, Shu-Guang Wang, Ying Shao, 2004 .

Density functional study of closed-shell attraction on X(ML)3+(X = O, S, Se; M = Au, Ag, Cu) systems

Shu-Guang Wang, H. Fang, 2006, Journal of molecular modeling.

Density functional study of aurophilic interaction in [X(AuPH3)2+]2 (X = F, Cl, br, I).

Xiaogang Zhang, Shu-Guang Wang, H. Fang, 2009, Physical chemistry chemical physics : PCCP.

Density functional studies of closed-shell attractions of S(AuPH3)2 and HS(AuPH3)2+ and their dimers

Xiaogang Zhang, Shu-Guang Wang, H. Fang, 2009, Journal of molecular modeling.

Phosphane-stabilized gold clusters: investigation of the stability of [Au13(PMe2Ph)10Cl2]3+

Jia Li, Shu-Guang Wang, 2010, Journal of molecular modeling.

Density functional study of aurophilic interaction in Cl(AuPH3) 2+ and in its dimerization

Xiaogang Zhang, Shu-Guang Wang, H. Fang, 2009 .

Bonding or nonbonding? Description or explanation? "Confinement bonding" of He@adamantane.

W. Schwarz, Shu-Guang Wang, Y. Qiu, 2009, Chemistry.

Does the 4f-shell contribute to bonding in tetravalent lanthanide halides?

W. Xu, Wenchao Ji, Shu-Guang Wang, 2014, The Journal of chemical physics.

A simple density functional fractional occupation number procedure to determine the low energy transition region of spin-flip reactions.

Shu-Guang Wang, Xianyang Chen, W. H. Eugen Schwarz, 2007, The Journal of chemical physics.

On structure and bonding of lanthanoid trifluorides LnF3 (Ln = La to Lu).

Wei Xu, W. Xu, Wenchao Ji, 2013, Physical chemistry chemical physics : PCCP.

Antibond breaking--the formation and decomposition of He@adamantane: descriptions, explanations, and meaning of concepts.

W. Schwarz, Shu-Guang Wang, Y. Qiu, 2010, Chemistry.

Stable Geometric and Electronic Structures of Gold-Coated Nanoparticles M@Au12 (M = 5d Transition Metals, from Hf to Hg): Ih or Oh?

Shu-Guang Wang, Xianyang Chen, Y. Qiu, 2008 .

Spin-flip reactions of Zr + C2H6 researched by relativistic density functional theory

Shu-Guang Wang, Xianyang Chen, Y. Qiu, 2013, Journal of Molecular Modeling.

Investigation of spin-flip reactions of Nb + CH3CN by relativistic density functional theory.

W. Schwarz, Qiang-Gen Li, Shu-Guang Wang, 2012, Physical chemistry chemical physics : PCCP.

Investigation of spin-flip reactions of Zr + CH3CN by relativistic density functional theory.

Qiang-Gen Li, Shu-Guang Wang, Xianyang Chen, 2012, The journal of physical chemistry. A.

Stable structures of LnSi6− and LnSi6 clusters (Ln = Pr, Eu, Gd, Tb, Yb), C2v or C5v? Explanation of photoelectron spectra

Wei Xu, Wenchao Ji, Shu-Guang Wang, 2015 .

Reaction mechanism of platinum dimer cation with ammonia based on the relativistic density functional study

Shu-Guang Wang, Xianyang Chen, Dan Xu, 2007 .

Bonding and electronic structures in W@Au12AE complexes (AE= NO+, CO, BF, CN–, or BO–): analogies among ligands isoelectronic to carbon monoxide

Jia Li, Shu-Guang Wang, Yinghui Fu, 2010, Journal of molecular modeling.

Ionic bonding of lanthanides, as influenced by d‐ and f‐atomic orbitals, by core–shells and by relativity

Wei Xu, W. H. Eugen Schwarz, Wen-Xin Ji, 2015, J. Comput. Chem..

Robust self-cleaning membrane with superhydrophilicity and underwater superoleophobicity for oil-in-water separation.

Ren Yue, Xue-Fei Sun, Shu-Guang Wang, 2023, Chemosphere.

On Relativity, Bonding, and Valence Electron Distribution

Wenjian Liu, W. Schwarz, Shu-Guang Wang, 2002 .

Quasi-relativistic density functional study of aurophilic interactions.

W. Schwarz, Shu-Guang Wang, Shu-Guang Wang, 2004, Journal of the American Chemical Society.

Structural change from doping the gold cluster

Jia Li, Shu-Guang Wang, Yiji Tang, 2011, Journal of molecular modeling.

Investigation on spin-flip reaction of Re + CH3CN by relativistic density functional theory.

Wenchao Ji, Shu-Guang Wang, Xianyang Chen, 2014, Dalton transactions.

Investigation of spin-flip reactions of Nb + CH3CN by relativistic density functional theory.

Qiang-Gen Li, Shu-Guang Wang, Xianyang Chen, 2012, Physical chemistry chemical physics : PCCP.

Geometric structure of X(AuPH3)4+ (X = N, P, As, Sb): Td or C4v?

Shu-Guang Wang, H. Fang, 2007, The journal of physical chemistry. A.