Zhongmin Liu, Yusuke Ootani, Shuichi Uehara, Jing Zhang, Qian Chen, Yang Wang, Nobuki Ozawa, Momoji Kubo. Coarse-grained molecular dynamics simulation of the effect of cross-linking on the wear mechanism of polymer brush. Chemistry Letters. 2024. 53. 3
Yusuke Ootani, Masaki Tsuchiko, Masayuki Kawaura, Mizuho Yokoi, Qian Chen, Yuta Asano, Nobuki Ozawa, Momoji Kubo. Reactive Molecular Dynamics Simulation Study on Atomic-Scale Adhesive Wear Mechanisms of Single Crystalline Body-Centered Cubic Iron. Tribology Letters. 2024. 72. 2
Yang Wang, Haoyu Zhao, Chang Liu, Yusuke Ootani, Nobuki Ozawa, Momoji Kubo. Mechanisms of chemical-reaction-induced tensile deformation of an Fe/Ni/Cr alloy revealed by reactive atomistic simulations. RSC Advances. 2023. 13. 10. 6630-6636
Yusuke Ootani, Momoji Kubo. Density-Functional Tight-Binding Molecular Dynamics Simulation of the Bending Mechanism of Molecular Crystals. The Journal of Physical Chemistry C. 2022. 126. 25. 10554-10565
Qian Chen, Jingxiang Xu, Yixin Su, Shuichi Uehara, Shandan Bai, Yang Wang, Yusuke Ootani, Nobuki Ozawa, Momoji Kubo. Chemical-Reaction-Induced deformation of Body-Centered cubic iron in supercritical water leading to high risk of cleavage Fracture: A reactive Molecular dynamics study. Computational Materials Science. 2022. 208. 111354-111354
Atomic-Scale Deformation/Fracture Process of Molecular Crystals: Density-Functional Tight Binding Molecular Dynamics Simulations
(The 3rd Materials Research Meeting (MRM 2023) / The 24th IUMRS-International Conference in Asia (IUMRS-ICA 2023) Kyoto, December 2023 2023)
Reactive Molecular Dynamics Simulation Study on Microscopic Corrosive Wear Process of Iron Nitride
(The 3rd Materials Research Meeting (MRM 2023) / The 24th IUMRS-International Conference in Asia (IUMRS-ICA 2023) 2023)
Frictional Property of Concentrated Polymer Brush Elucidated by Molecular Dynamics Simulation
(Summit of Materials Science 2023 and GIMRT User Meeting 2023 2023)
Density-Functional Tight Binding Molecular Dynamics Approach for Deformation/Fracture Mechanisms of Molecular Crystals
(The 5th conference of Theory and Applications of Computational Chemistry 2023)
Molecular Dynamics Simulation Study on Tribochemical Reaction in Water Lubrication of Silicon Carbide
(9th International Tribology Conference, Fukuoka 2023 2023)
