Basic Information

 

Name	王巍巍
Profession	东京大学博士后
Native place	山东
Hobby	看书
E-mail	herb.vv@stu.xjtu.edu.cn

 

 

Research Fields

缺陷碳纳米材料的理论研究

 

Publications

2017

[29] Revisit of the Saito-Dresselhaus-Dresselhaus C₂ Ingestion Model: on the Mechanism of Atomic-Carbon-Participated Fullerene Growth

Wei-Wei Wang, Jing-Shuang Dang, Xiang Zhao* and Shigeru Nagase

Nanoscale, 2017, 9, 16742-16748.

DOI: 10.1039/c7nr04966h

 

 

[28] A Mechanistic Study on Cationic Li Prompted Diels-Alder Cycloaddition of Cycloparaphenylene

Jing-Shuang Dang, Wei-Wei Wang, Xiang Zhao* and Shigeru Nagase

Org. Chem. Front., 2017, 4, 1757-1761. 

DOI: 10.1039/C7QO00290D

 

 

[27] Formation of Stone-Wales Edge: Multistep Reconstruction and Growth Mechanisms of Zigzag Nanographene

 

Jing-Shuang Dang, Wei-Wei Wang, Jia-Jia Zheng, Xiang Zhao* and Shigeru Nagase

 

J. Comput. Chem. 2017, 38, 2241-2247.

DOI: 10.1002/jcc.24871

 

 

[26] Concave Binding of Cationic Li to Quadrannulene

Jing-Shuang Dang, Wei-Wei Wang, Xiang Zhao* and Shigeru Nagase

Phys. Chem. Chem. Phys. 2017, 19, 20773-20777.

DOI: 10.1039/C7CP02512B

 

 

[25] Fused-Pentagon-Configuration-Dependent Electron Transfer of Monotitanium-Encapsulated Fullerenes

Jing-Shuang Dang, Wei-Wei Wang, Jia-Jia Zheng, Xiang Zhao* and Shigeru Nagase

Inorg. Chem. 2017, 56, 6890-6896.

DOI: 10.1021/acs.inorgchem.7b00284

 

 

2016

[24] Unconventional Electronic Structure and Chlorination/Dechlorination Mechanisms of ^#1911C₆₄ Fullerene

Jing-Shuang Dang, Wei-Wei Wang, Xiang Zhao* and Shigeru Nagase

Inorg. Chem. 2016, 55, 6827-6829.

DOI:10.1021/acs.inorgchem.6b00642

 

 

[23] Magnetic and Electronic Properties of Porphyrin-Based Molecular Nanowires

Jia-Jia Zheng, Qiao-Zhi Li, Jing-Shuang Dang, Wei-Wei Wang and Xiang Zhao*

AIP Adv. 2016, 6, 015216.

DOI:10.1063/1.4941073

 

[22] Regioselective Multistep Reconstructions of Half-Saturated Zigzag Carbon Nanotubes

Wei-Wei Wang, Jing-Shuang Dang, Xiang Zhao* and Shigeru Nagase

J. Comput. Chem. 2016, 37,1363-1366.

DOI:10.1002/jcc.24343

 

[21] Formation Mechanisms of Graphitic-N: Oxygen Reduction and Nitrogen Doping of Graphene Oxides

Wei-Wei Wang, Jing-Shuang Dang, Xiang Zhao* and Shigeru Nagase

J. Phys. Chem. C 2016, 120, 5673-5681.

DOI:10.1021/acs.jpcc.5b10607

2015

[20] Preparation, Structural Determination, and Characterization of Electronic Properties of Bis-silylated and Bis-germylated Lu₃N@I_h-C₈₀

Masahiro Kako, Kyosuke Miyabe, Kumiko Sato, Mitsuaki Suzuki, Naomi Mizorogi, Wei-Wei Wang, Michio Yamada, Yutaka Maeda, Marilyn M. Olmstead, Alan L. Balch, Shigeru Nagase and Takeshi Akasaka

Chem.-Eur. J. 2015, 21, 16411-16420.

DOI:10.1002/chem.201502511

 

[19] Synthesis, Structure, and Reactivities of Iminosulfane- and Phosphane-Stabilized Carbones Exhibiting Four-Electron Donor Ability

Tomohito Morosaki, Wei-Wei Wang, Shigeru Nagase and Takayoshi Fujii

Chem.-Eur. J. 2015, 21, 15405-15411.

DOI:10.1002/chem.201502166

 

2014

[18] Quantum Chemical Determination of Novel C₈₂ Monometallofullerenes Involving a Heterogeneous Group

Hong Zheng, Xiang Zhao*, Ling He, Wei-Wei Wang and Shigeru Nagase

Inorg. Chem. 2014, 53, 12911-12917.

DOI:10.1021/ic501911z

 

[17] Regioselective Derivatization of C₈₄ by Diels‒Alder Reactions: Applications to Photovoltaic Solar Cells and Fullerene Polymerization

Jing-Shuang Dang, Wei-Wei Wang, Xiang Zhao* and Shigeru Nagase

Org. Lett. 2014, 16, 170-173.

DOI:10.1021/ol403157j

 

[16] Isolation and Characterization of 5,6-pyrrolidino-Sc₃N@I_h-C₈₀ Diastereomers

Yutaka Maeda, Masato Kimura, Chihiro Ueda, Michio Yamada, Toru Kikuchi, Mitsuaki Suzuki, Wei-Wei Wang, Naomi Mizorogi, Nikolaos Karousis, Nikos Tagmatarchis, Tadashi Hasegawa, Marilyn M. Olmstead, Alan L. Balch, Shigeru Nagase and Takeshi Akasaka

Chem. Commun. 2014, 50, 12552-12555.

DOI:10.1039/c4cc04946b

 

[15] Syntheses, Structures, and Reactivities of Two Chalcogen-Stabilized Carbones

Tomohito Morosaki, Tsubasa Suzuki, Wei-Wei Wang, Shigeru Nagase and Takayoshi Fujii

Angew. Chem. Int. Ed. 2014, 53, 9569-9571.

DOI:10.1002/anie.201404795

 

[14] Regioselective Synthesis and Molecular Structure of the First Derivative of Praseodymium-Containing Metallofullerenes

Qin Zhou, Hui Li, Yong-Fu Lian, Mitsuaki Suzuki, Li-Piao Bao, Wen-Ting Cai, Wei-Wei Wang, Shigeru Nagase, Xing Lu and Takeshi Akasaka

Chem. Commun. 2014, 50, 9876-9878.

DOI:10.1039/c4cc02949f

 

2013

[13] Quantum Chemical Insight into Metallofullerenes M₂C₉₈: M₂C₂@C₉₆ or M₂@C₉₈, Which Will Survive?

Hong Zheng, Xiang Zhao*, Wei-Wei Wang, Jing-Shuang Dang and Shigeru Nagase

J. Phys. Chem. C 2013, 117, 25195-25204.

DOI:10.1021/jp409915t

 

[12] Selective Growth of Fullerenes from C₆₀ to C₇₀: Inherent Geometrical Connectivity Hidden in Discrete Experimental Evidence

Wei-Wei Wang, Jing-Shuang Dang, Jia-Jia Zheng, Xiang Zhao* and Shigeru Nagase

J. Phys. Chem. C 2013, 117, 2349-2357.

DOI:10.1021/jp3100766

 

[11] Open-Shell Triplet Character of ^#6094C₆₈: Spherical Aromaticity, Thermodynamic Stability, and Regioselective Chlorination

Jing-Shuang Dang, Jia-Jia Zheng, Wei-Wei Wang and Xiang Zhao*

Inorg. Chem. 2013, 52, 4762-4764.

DOI:10.1021/ic400290a

 

[10] Regiochemistry of Nonclassical C₆₂ Fullerene: Role of Tetragonal Carbocyclic Ring in Cycloadditions and Thermal/Photoinduced Interconversions of Fulleroid Derivatives

Jing-Shuang Dang, Wei-Wei Wang, Shigeru Nagase and Xiang Zhao*

J. Phys. Chem. C 2013, 117, 12882-12889.

DOI:10.1021/jp402621e

 

2012

[9] Sc₂@C₇₀ Rather Than Sc₂C₂@C₆₈: Density Functional Theory Characterization of Metallofullerene Sc₂C₇₀

Hong Zheng, Xiang Zhao*, Wei-Wei Wang, Tao Yang and Shigeru Nagase

J. Chem. Phys. 2012, 137, 014308.

DOI:10.1063/1.4769864

 

[8] C₇₄ Endohedral Metallofullerenes Violating the Isolated Pentagon Rule: A Density Functional Theory Study

Hong Zheng, Xiang Zhao*, Ting Ren and Wei-Wei Wang

Nanoscale 2012, 4, 4530-4536.

DOI:10.1039/c2nr30865g

 

[7] Probing the Role of Encapsulated Alkaline Earth Metal Atoms in Endohedral Metallofullerenes M@C₇₆ (M = Ca, Sr, and Ba) by First-Principles Calculations

Tao Yang, Xiang Zhao*, Qian Xu, Hong Zheng, Wei-Wei Wang and Sheng-Tao Li

Dalton. Trans. 2012, 41, 5294-5300.

DOI:10.1039/c2dt12420c

 

[6] Metal-Promoted Restoration of Defective Graphene

Wei-Wei Wang, Jing-Shuang Dang, Jia-Jia Zheng, Xiang Zhao*, Eiji Osawa and Shigeru Nagase

J. Mater. Chem. 2012, 22, 16370-16375.

DOI:10.1039/c2jm31703f

 

[5] Heptagons in C₆₈: Impact on Stabilities, Growth, and Exohedral Derivatization of Fullerenes

Wei-Wei Wang, Jing-Shuang Dang, Jia-Jia Zheng and Xiang Zhao*

J. Phys. Chem. C 2012, 116, 17288-17293.

DOI:10.1021/jp304891e

 

[4] Impact of Tetragonal Rings on the Stability of Small Fullerenes Encapsulated with Noble Gas: A Density Functional Theory Survey

Wei-Wei Wang, Jing-Shuang Dang and Xiang Zhao*

Chem. Phys. Lett. 2012, 536, 77-81.

DOI:10.1016/j.cplett.2012.03.055

 

[3] Fullerene Genetic Code: Inheritable Stability and Regioselective C₂ Assembly

Jing-Shuang Dang, Wei-Wei Wang, Jia-Jia Zheng, Xiang Zhao*, Eiji Osawa and Shigeru Nagase

J. Phys. Chem. C 2012, 116, 16233-16239.

DOI:10.1021/jp302881u

 

2011

[2] Density Functional Theory Characterization of Lanthanum Nitride Endohedral Fullerene: La₃N@C₉₂

Jia-Jia Zheng, Xiang Zhao*, Jing-Shuang Dang, Yong-Mei Chen, Qian Xu and Wei-Wei Wang

Chem. Phys. Lett. 2011, 514, 104-108.

DOI:10.1016/j.cplett.2011.08.026

 

[1] Role of Four-Membered Rings in C₃₂ Fullerene Stability and Mechanisms of Generalized Stone‒Wales Transformation: A Density Functional Theory Investigation

Wei-Wei Wang, Jing-Shuang Dang and Xiang Zhao*

Phys. Chem. Chem. Phys. 2011, 13, 14629-14635.

DOI:10.1039/c0cp02964e