Meetings

+FY 2018

2019. 3.16-19 The 99th CSJ Annual Meeting [Okamoto Campus, Konan University (Kobe, Japan)]: - 1PC-012 Molecular Dynamics Simulation Analysis of Electrode Electrolyte Interface using Amorphous Carbon Electrode Model
2018.12.5-8 IRSEC'18 - 6th International Renewable and Sustainable Energy Conference [Dawliz Resort & Spa (Rabat, Morocco)]: - [Poster] Microscopic Mechanism of FEC Concentration Effect on SEI Film Formation in Na-ion Batteries
2018.11.28-30 The 32nd Molecular Simulation Symposium [AIST Tsukuba Central Auditorium, National Institute of Advanced Industrial Science and Technology (Ibaraki, Japan)]: - 215P Theoretical study of constant pH method based on the configuration selection method satisfied zero energy difference condition
- 232P Effect of polarizable electrode surface model on interfacial kinetics of ionic liquid
- 243P Structural stability analysis of solid electrolyte interphase (SEI) film in lithium ion battery by using constant potential molecular dynamics method
2018.11.4-8 Joint Conference of EMLG/JMLG Meeting 2018 and 41st Symposium on Solution Chemistry of Japan [Engineering and Science Building, Nagoya University (Aichi, Japan)]: - P029 Application of QM/MM-Red Moon Method to Solid Electrolyte Interphase Film Formation in Lithium-ion Battery System
2018.10.22-23 PCoMS Symposium & Annual meeting of Supercomputing Consortium for Computational Materials Science 2018 [Institute for Materials Research, Katahira Campus,TOHOKU University (Miyagi, Japan)]: - PS11 Theoretical analysis of structural stability of passivation film in Li-ion battery
2018.10.17-21 Quantum International Frontiers 2018 [Fenglin Hotel (Changsha, P.R. China)]: - [Poster] Tacticity Prediction of Poly(methyl methacrylate) from Radical Polymerization via Red Moon Methodology
- [Poster] The Influence of Chemical Substituents on Linker Rotational Behavior in Pillar-layered MOFs by Computational Method
2018.9.10-13 The 12th Annual Meeting of Japan Society for Molecular Science [Fukuoka International Congress Center (Fukuoka, Japan)]: - 2P078 Theoretical study on mechanism for controlling hemoglobin function by allosteric interaction with chloride ions
- 2P104 Microscopic Structure of Hydrate Melt Electrolyte for Aqueous Li-Ion Batteries on Electrode Surface
- 2P113 Theoretical analysis of Au electrode potential shift by ionic liquid
- 3P095 Theoretical elucidation of aggregation process in aqueous aluminum solution - its initial process and pH dependence -
- 4P020 Quantum chemical analysis of SN1 reaction of 3-Chloro-3,7-dimethyloctane in methanol : Toward microscopic understanding of the generation process of enantiomers
- 4P049 Quantum chemical analysis on hydrogen generation mechanism in decomposition process of lubricant molecules
- 4P100 Theoretical analysis of the active site opening mechanism in olefin polymerization reaction by ansa-zirconocene catalyst
2018.8.20-22 CSE 1st Young Researcher Workshop [(Shizuoka, Japan)]: - Oral Presentation(Branch B) Constant potential MD simulation method and its applications to electrochemical interfaces
2018.6.18-22 The 19th International Meeting on Lithium Batteries [Kyoto international conference center (Kyoto, Japan)]: - P414 Macroscopic Mechanisms of SEI Film Formation in Li-Ion Batteries with Highly Concentrated Electrolyte
- P854 Microscopic Effect of FEC Additive Concentration on SEI Film Formation in Na-ion Batteries
2018.5.15-17 The 21th Theoretical Chemistry Symposium [Okazaki Conference Center (Aichi, Japan)]: - P48 Theoretical study on hydrogen generation mechanism in decomposition process of lubricant molecules using QM method
- P49 Theoretical study on allosteric regulation of hemoglobin by chloride ions
- P50 Model preparation of radical polymerization of PMMA toward prediction of tacticity by Red Moon methodology
- P51 Program development of force field parameter optimization by local data modeling method

>> FY 2017