Zhi-Cheng Sun

发表

Prototypical metal–oxo bonds: the reactions of Cr(PF3)6, Fe(PF3)5, and Ni(PF3)4 with oxygen

H. Schaefer, Yaoming Xie, R. Zhong, 2015, Theoretical Chemistry Accounts.

Reactions of amine and peroxynitrite: evidence for hydroxylation as predominant reaction and new insight into the modulation of CO2.

R. Zhong, Yong Dong Liu, Zhi-Cheng Sun, 2012, The journal of physical chemistry. A.

Theoretical investigation of reactivities of amines in the N-nitrosation reactions by N2O3

R. Zhong, Yong Dong Liu, Zhi-Cheng Sun, 2011, Journal of molecular modeling.

Does the metal–metal sextuple bond exist in the bimetallic sandwich compounds Cr2(C6H6)2, Mo2(C6H6)2, and W2(C6H6)2?†

H. Schaefer, Yaoming Xie, R. Zhong, 2013 .

The reactions of Cr(CO)6, Fe(CO)5, and Ni(CO)4 with O2 yield viable oxo‐metal carbonyls

Zhi Sun, Rugang Zhong, Yaoming Xie, 2014, J. Comput. Chem..

Theoretical investigation of the isomerization and dissociation reactions of all the HOONO2 isomers

J. Zhao, R. Zhong, Yong Dong Liu, 2010 .

Vibrational frequencies, structures, and energetics of the highly challenging alkali metal trifluorides MF3 (M = Li, Na, K, Rb, and Cs).

H. Schaefer, Zhi-Cheng Sun, 2018, Physical chemistry chemical physics : PCCP.

Prediction and Characterization of Alkaline-Earth (M=Be, Mg, Ca, Sr, and Ba) Metallacyclopentadienes and Relevant Derivatives

H. Schaefer, Zhi-Cheng Sun, Andrew M. Launder, 2017 .

�he In�uence of �hos�hate �u�er on the Formation of N-Nitrosodimethylamine fromDimethylamine Nitrosation

R. Zhong, Yong Dong Liu, Long-He Xu, 2015 .

The Influence of Phosphate Buffer on the Formation of N-Nitrosodimethylamine from Dimethylamine Nitrosation

Fengchang Wu, R. Zhong, Yong Dong Liu, 2013 .

Carbon dioxide in the nitrosation of amine: catalyst or inhibitor?

R. Zhong, Yong Dong Liu, Zhi-Cheng Sun, 2011, The journal of physical chemistry. A.

Thioformaldehyde S-Sulfide, Sulfur Analogue of the Criegee Intermediate: Structures, Energetics, and Rovibrational Analysis.

H. Schaefer, Jay Agarwal, Zhi-Cheng Sun, 2017, The journal of physical chemistry. A.

The Hydrogen Abstraction Reaction H2S + OH → H2O + SH: Convergent Quantum Mechanical Predictions.

H. Schaefer, Xiang-Rong Chen, Yaoming Xie, 2017, The journal of physical chemistry. A.

Experimental and Theoretical Investigation of Effects of Ethanol and Acetic Acid on Carcinogenic NDMA Formation in Simulated Gastric Fluid.

R. Zhong, Yong Dong Liu, X. Zou, 2016, The journal of physical chemistry. A.

Theoretical investigation of the isomerization of N2O3 and the N-nitrosation of dimethylamine by asym-N2O3, sym-N2O3, and trans–cis N2O3 isomers

R. Zhong, Yong Dong Liu, Chunlin Lv, 2009 .

Theoretical Investigation of N-Nitrosation Mechanism of Amino Acids Mediated by N2O3

R. Zhong, Yong Dong Liu, Zhi-Cheng Sun, 2009, International Conferences on Biomedical and Bioinformatics Engineering.

Cyclobutyne: Minimum or Transition State?

H. Schaefer, Zhi-Cheng Sun, 2019, The Journal of organic chemistry.

Communication: The Al + CO2 → AlO + CO reaction: Experiment vs. theory.

Kevin B. Moore, H. Schaefer, Zhi-Cheng Sun, 2017, The Journal of chemical physics.

Alkali-Metal Trihalides: M+X3- Ion Pair or MX-X2 Complex?

Kevin B. Moore, H. Schaefer, R. Hoffmann, 2017, The journal of physical chemistry. B.