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Home > Topics > Mr.Takahiro Tsuzuk Awarded Best Poster Presentation Award, The 5th International Conference on Molecular Simulation (ICMS 2019).

Mr.Takahiro Tsuzuk Awarded Best Poster Presentation Award, The 5th International Conference on Molecular Simulation (ICMS 2019).

Category:Award|Publishing : November 19, 2019


Award winner

Mr.Takahiro Tsuzuki, Department of Physical Science and Engineering

Best Poster Presentation Award, The 5th International Conference on Molecular Simulation (ICMS 2019)
ICMS 2019

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Award-winning research


The Li-ion battery (LIB) has been expected further improvement for wider usage. In this research, we have performed the first-principles molecular dynamics simulations of the SWCNT-encapsulated quinones molecules with/without Li using our divide-&-conquer-type real-space grid DFT code optimized for many-core-type supercomputers. We have thereby found their electronic structures, atomic configurations, and Li-ion transfer dynamics during the charging/discharging process as the positive electrode of the next-generation LIB, which are difficult be observed in experiments.

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Award winner's comments


I am honored to be awarded this great prize. I greatly acknowledge my supervisor (Prof. Shuji Ogata), laboratory members, collaborators (Profs. Shinji Kawasaki and Yosuke Ishii of NITech), and my family members. I will put my best effort to research and develop various materials.

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