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Asian International Symposium » International Symposium on Molecular Science - Physical Chemistry / Theoretical Chemistry, Chemoinformatics, Computational Chemistry - Cosponsored by Japan Society for Molecular Science

[W1-1vn] International Symposium on Molecular Science - Physical Chemistry / Theoretical Chemistry, Chemoinformatics, Computational Chemistry - Cosponsored by Japan Society for Molecular Science

Wed. Mar 23, 2022 4:10 PM - 5:30 PM W1 (Online Meeting)

Chair, Symposium organizer: Tatsuya Ishiyama, Akiyoshi Hishikawa

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4:10 PM - 4:45 PM

[W1-1vn-01] Ion transport in concentrated aqueous electrolytes for Li-ion batteries

Asia Special Lecture

^○Jonggu Jeon¹ (1. Institute for Basic Science)

[Lang.] English

4:45 PM - 5:05 PM

[W1-1vn-02] Theoretical Investigation of Dielectric Constant at Monolayer Interfaces by Polarizable Molecular Dynamics Simulation

Invited Lecture

^○Lin Wang^1,2 (1. Department of Chemistry, Tohoku Univ., 2. ESICB, Kyoto Univ.)

[Lang.] English

5:05 PM - 5:25 PM

[W1-1vn-03] Understanding Charge-Transfer Reactions by Constrained Density Functional Theory

Invited Lecture

^○Tatsuya Joutsuka^1,2 (1. Ibaraki University, 2. Frontier Research Center for Applied Atomic Sciences)

[Lang.] English

Closing Remarks (5:25 PM - 5:30 PM)

Session information

[W1-1vn] International Symposium on Molecular Science - Physical Chemistry / Theoretical Chemistry, Chemoinformatics, Computational Chemistry - Cosponsored by Japan Society for Molecular Science

[W1-1vn-01] Ion transport in concentrated aqueous electrolytes for Li-ion batteries

Asia Special Lecture

[W1-1vn-02] Theoretical Investigation of Dielectric Constant at Monolayer Interfaces by Polarizable Molecular Dynamics Simulation

Invited Lecture

[W1-1vn-03] Understanding Charge-Transfer Reactions by Constrained Density Functional Theory

Invited Lecture

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