[A204-3am] 02. Theoretical Chemistry, Chemoinformatics, and Computational Chemistry

[A204-3am-09] On the investigation of electrostatic interaction analysis and infrared band prediction for water molecules inside polymer materials

^○Yoshiki Ishii¹, Hajime Torii², Yuka Ikemoto³, Hitoshi Washizu¹ (1. Univ. of Hyogo, 2. Shizuoka Univ., 3. JASRI)

[Lang.] Japanese

Keywords:Molecular Dynamics, Electrostatic Interaction, Infrared Spectroscopy, Polymer, Water