王杨，西南交通大学前沿科学研究院教授（青年PI），博士生导师

    研究方向主要包括：

      ①多尺度计算机模拟方法开发和应用

      ②微纳尺度摩擦化学和磨损机理

    非常欢迎对摩擦学、计算机模拟、编程、物理化学感兴趣的同学加入！

发表论文(粗体为本人；下划线为第一作者；*为通讯作者)：

1.       Yang Wang, Jingxiang Xu, Yusuke Ootani, Nobuki Ozawa, Koshi Adachi, and Momoji Kubo*, “Non-empirical law for nanoscale atom-by-atom wear”, Advanced Science, 8 (2021) 2002827. (IF: 16.806, 日本经济新闻于2020年12月8日、日本航空新闻社于2020年12月9日、日刊工业新闻于2020年12月20日对该结果进行了报道，封面论文)

2.       Yang Wang, Naohiro Yamada, Jingxiang Xu, Jing Zhang, Qian Chen, Yusuke Ootani, Yuji Higuchi, Nobuki Ozawa, Maria-Isabel De Barros Bouchet, Jean Michel Martin, Shigeyuki Mori, Koshi Adachi, and Momoji Kubo*, “Triboemission of hydrocarbon molecules from diamond-like carbon friction interface induces atomic-scale wear”, Science Advances, 5 (2019) eaax9301. (IF: 14.136, 日经产业新闻于2019年12月2日、日刊工业新闻于2019年12月10日对该结果进行了报道)

3.       Yang Wang, Jingxiang Xu, Yusuke Ootani, Nobuki Ozawa, Koshi Adachi, and Momoji Kubo*, “Proposal of a new formation mechanism for hydrogenated diamond-like carbon transfer films: Hydrocarbon-emission-induced transfer”, Carbon, 154 (2019) 7-12. (IF: 9.594)

4.       Yang Wang, Jingxiang Xu, Jing Zhang, Qian Chen, Yusuke Ootani, Yuji Higuchi, Nobuki Ozawa, Jean Michel Martin, Koshi Adachi, and Momoji Kubo*, “Tribochemical reactions and graphitization of diamond-like carbon against alumina give volcano-type temperature dependence of friction coefficients: A tight-binding quantum chemical molecular dynamics simulation”, Carbon, 133 (2018) 350-357. (IF: 9.594)

5.       Yang Wang, Jingxiang Xu, Yusuke Ootani, Shandan Bai, Yuji Higuchi, Nobuki Ozawa, Koshi Adachi, Jean Michel Martin, and Momoji Kubo*, “Tight-binding quantum chemical molecular dynamics study on the friction and wear processes of diamond-like carbon coatings: Effect of tensile stress”, ACS Applied Materials & Interfaces, 9 (2017) 34396-34404. (IF: 9.229)

6.       Yang Wang, Yixin Su, Jing Zhang, Qian Chen, Jingxiang Xu, Shandan Bai, Yusuke Ootani, Nobuki Ozawa, Maria-Isabel De Barros Bouchet, Jean Michel Martin, Koshi Adachi, and Momoji Kubo*, “Reactive molecular dynamics simulations of wear and tribochemical reactions of diamond-like carbon interfaces with nanoscale asperities under H₂ gas: Implications for solid lubricant coatings”, ACS Applied Nano Materials, 3 (2020) 7297-7304. (IF: 5.097)

7.       Yang Wang, Kentaro Hayashi, Yusuke Ootani, Shandan Bai, Tomomi Shimazaki, Yuji Higuchi, Nobuki Ozawa, Koshi Adachi, Maria-Isabel De Barros Bouchet, Jean-Michel Martin, and Momoji Kubo*, “Role of OH-termination in mitigating friction of diamond-like carbon under high load: a joint simulation and experimental study”, Langmuir, 37 (2021) 6292-6300. (IF: 3.882，封面论文)

8.       Yang Wang, Yuqing Shi, Qiang Sun, Kang Lu, Momoji Kubo, and Jingxiang Xu*, “Development of a transferable ReaxFF parameter set for carbon and silicon based solid lubricating systems”, Journal of Physical Chemistry C, 124 (2020) 10007-10015. (IF: 4.126)

9.       Yang Wang, Keita Yukinori, Ryo Koike, Yusuke Ootani, Koshi Adachi, and Momoji Kubo*, “Selective wear behaviors of silicon from SiC surface under water-lubricated and rotating-contact condition revealed by large-scale reactive molecular dynamics simulation”, Journal of Physical Chemistry C, 125 (2021) 14957-14964. (IF: 4.126，封面论文)

10.   Kentaro Kawaguchi, Yang Wang, Jingxiang Xu, Yusuke Ootani, Yuji Higuchi, Nobuki Ozawa, and Momoji Kubo*, “Atom-by-atom and sheet-by-sheet chemical mechanical polishing of diamond assisted by OH radicals—A tight-binding quantum chemical molecular dynamics simulation study”, ACS Applied Materials & Interfaces, 13 (2021) 41231-41237. (IF: 9.229，封面论文)

11.   Kentaro Kawaguchi, Yang Wang, Jingxiang Xu, Yuji Higuchi, Nobuki Ozawa, and Momoji Kubo*, “Cooperative roles of chemical reactions and mechanical friction in chemical mechanical polishing of gallium nitride assisted by OH radicals: Tight-binding quantum chemical molecular dynamics simulations”, Physical Chemistry Chemical Physics, 23 (2021) 4075-4084. (IF: 3.676，封面论文)

12.   Jingxiang Xu*, Yang Wang*, Yuxin Cen, Bowen Xing, Xingwei Zheng, Yusuke Ootani, and Momoji Kubo, “Prediction of macroscopic properties of diamond-like carbon from atomic-scale structure”, Journal of Physical Chemistry C, 123 (2019) 24609-24614. (IF: 4.126)

13.   Jingxiang Xu*, Kang Lu, Ding Fan*, Yang Wang*, Shaolin Xu, and Momoji Kubo, “Different etching mechanisms of diamond by oxygen and hydrogen plasma: A reactive molecular dynamics study”, Journal of Physical Chemistry C, 125 (2021) 16711-16718. (IF: 4.126)

14.   Shandan Bai, Jingxiang Xu, Yang Wang, Qi Zhang, Takeshi Tsuruda, Yuji Higuchi, Nobuki Ozawa, Koshi Adachi, Jean Michel Martin, and Momoji Kubo*, “Generation of “graphene arch-bridge” on a diamond surface by Si doping: A first-principles computational study”, Journal of Physical Chemistry C, 124 (2020) 26379-26386. (IF: 4.126)

15.   Yusuke Ootani, Jingxiang Xu, Fumiya Nakamura, Masayuki Kawaura, Shuichi Uehara, Koki Kanda, Yang Wang, Nobuki Ozawa, Koshi Adachi, and Momoji Kubo*, “Three tribolayers self-generated from SiC individually work for reducing friction in different contact pressures”, Journal of Physical Chemistry C, 126 (2022) 2728-2736. (IF: 4.126)

16.   Yusuke Ootani, Jingxiang Xu, Naoki Takahashi, Kenta Akagami, Satoshi Sasaki, Yang Wang, Nobuki Ozawa, Takahiro Hatano, Koshi Adachi, and Momoji Kubo*, “Self-formed double tribolayers play collaborative roles in achieving superlow friction in aqueous environment”, Journal of Physical Chemistry C, 124 (2020) 8295-8303. (IF: 4.126)

17.   Yun Long, Yang Wang, Maria-Isabel De Barros*, Volker Weihnacht, Stefan Makowski, Momoji Kubo, and Jean Michel Martin, “Mechanism of superlubricity of a DLC/Si₃N₄ contact in the presence of castor oil and other green lubricants”, Friction, in press. (IF: 6.167)

18.   Shuichi Uehara, Yang Wang, Yusuke Ootani, Nobuki Ozawa, and Momoji Kubo*, “Molecular-level elucidation of a fracture process in slide-ring gels via coarse-grained molecular dynamics simulations”, Macromolecules, in press. (IF: 5.918)

19.   Qian Chen, Jing Zhang, Zhongmin Liu, Yang Wang, Yusuke Ootani, Jingxiang Xu, Nobuki Ozawa, and Momoji Kubo*, “Heterogeneous yielding mechanisms of body center cubic iron for high resistance to chemical reaction-induced deterioration in supercritical water environments: A reactive molecular dynamics study”, Scripta Materialia, 202 (2021) 113997. (IF: 5.611)

20.   Zhongmin Liu, Yusuke Ootani, Shuichi Uehara, Jingxiang Xu, Yang Wang, Narumasa Miyazaki, Yuji Higuchi, Nobuki Ozawa, and Momoji Kubo*, “Coarse-grained molecular dynamics simulation on the wear mechanism of cyclic polymer brush”, Chemistry Letters, 49 (2020) 1185-1188. (IF: 1.361)

21.   Zhuqing Wang*, Jinlong Lv, Jinhua Li, Yang Wang, and Jingshuai Sun, “Fabrication and evaluation of micro channels array for flexible on-chip PEMFC by new evaluation method and self-made hot-embossing system”, International Journal of Advanced Manufacturing Technology, 108 (2020) 1381-1387. (IF: 2.633)

22.   Yixin Su, Jing Zhang, Qian Chen, Yang Wang, Narumasa Miyazaki, Yusuke Ootani, Nobuki Ozawa, and Momoji Kubo*, “A molecular dynamics study on alumina/carbon nanotube composite: How does annealing affect mechanical properties?”, Journal of Computer Chemistry, Japan, 18 (2019) 259-262.

23.   Jing Zhang, Yang Wang, Qian Chen, Yixin Su, Jingxiang Xu, Yusuke Ootani, Nobuki Ozawa, Koshi Adachi, and Momoji Kubo*, “Graphitization dynamics of DLC under water lubrication revealed by molecular dynamics simulation”, Journal of Computer Chemistry, Japan, 18 (2019) 103-104.

24.   Masayuki Kawaura, Yang Wang, Yusuke Ootani, Nobuki Ozawa, and Momoji Kubo*, “Reactive molecular dynamics simulation on friction-induced chemical reactions of SiC in water environments”, Journal of Computer Chemistry, Japan, 19 (2020) 139-141.

25.   Hiroki Murabayashi, Takeshi Tsuruda, Yang Wang, Yoshihiko Kobayashi, Shandan Bai, Yuji Higuchi, Nobuki Ozawa, Koshi Adachi, and Momoji Kubo*, “Tribo-chemical reaction of molybdenum dithiocarbamate on diamond-like carbon films: Quantum chemical molecular dynamics simulation”, Journal of Computer Chemistry, Japan, 13 (2014) 117-118. (In Japanese)

综述：

1.  Yusuke Ootani, Yang Wang, Koshi Adachi, and Momoji Kubo, “Molecular Dynamics Simulation on Wear of Sliding Materials Brought by Mechanically Induced Chemical Reactions at Sliding Interfaces (摩擦界面において力学的に誘起される化学反応かもたらす摩耗の分子動力学シミュレーション)”, 理論化学会誌「フロンティア」第3巻第2号ページ74-80.

会议邀请报告：

1.       Yang Wang, et al., “A molecular dynamics study on the tribological properties of diamond-like carbon in hydrogen gas environment”, Carbon 2018, Madrid, Spain, July 1-6, 2018. (Keynote Lecture)

2.       王杨，“计算模拟的方法研究DLC的摩擦及磨损”，第十四届全国摩擦学大会，广州，2019.11.10-13.

会议报告：

(Oral Presentation)

1.       Yang Wang, et al., “Simulations and experiments exploring the role of OH-termination in the lubricity and stability of diamond-like carbon”, ELyT Workshop 2020, Lyon, France, February 17-19, 2020.

2.       Yang Wang, et al., “Development of theoretical wear equation unveiling the origin of Archard’s law and its failure at nanoscale”, International Tribology Conference Sendai 2019, Sendai, Japan, September 17-21, 2019.

3.       Yang Wang, et al., “Atomistic simulations reveal the wear mechanisms of diamond-like carbon and propose principles on wear reduction”, Tribochemistry Hakodate 2019, Hakodate, Japan, September 12-14, 2019.

4.       Yang Wang, et al., “A molecular dynamics study on the wear mechanisms of hydrogenated diamond-like carbon”, The 9th International Conference on Multiscale Materials Modeling, Osaka, Japan, October 28-November 2, 2018.

5.       Yang Wang, et al., “Tight-binding quantum chemical molecular dynamics simulation study on tribological behaviors of diamond-like carbon against aluminum”, 6th World Tribology Congress, Beijing, China, September 16-22, 2017.

6.       Yang Wang, et al., “A tight-binding quantum molecular dynamics study of atomic-scale fracture induced by high stress and friction on diamond-like carbon coatings”, International Tribology Conference Tokyo 2015, Tokyo, Japan, September 16-20, 2015.

7.       Yang Wang, et al., “Quantum chemical molecular dynamics study of atomic-scale fracture induced by high stress and friction on diamond-like carbon coatings”, Imperial College-Tohoku University Mini-Workshop on the Structural Integrity and Strength of Energy System Materials, London, United Kingdom, March 20-21, 2015.

(Poster Presentation)

1.       Yang Wang, et al., “Investigation on friction properties of diamond-like carbon against alumina at high temperature: A tight-binding quantum chemical molecular dynamics simulation approach”, 2017 MRS Spring Meeting & Exhibit, Phoenix, USA, April 18-21, 2017.

2.       Yang Wang, et al., “A theoretical study on the friction properties of hydrogen-free diamond-like carbon against alumina at high temperature”, The 10th Anniversary General Meeting of ACCMS-VO (Asian Consortium on Computational Materials Science - Virtual Organization), Sendai, Japan, November 1-3, 2015.

3.       Yang Wang, et al., “A theoretical investigation at atomic-scale degradation of diamond-like carbon coatings induced by stress during friction”, Tribochemistry Nikko 2019, Nikko, Japan, September 13-15, 2015.