First-Principles Calculation on the Adsorption of Ethylene-Acrylic Acid Molecules on Chromium Oxide Surfaces.

ABSTRACT: Currently, hybrid materials composed of metals and polymers are used in various fields, including aerospace and biomedicine. Specifically, laminated strips composed of chrome-plated steel and ethylene-acrylic acid (EAA), which are the focus of this study, are used as protective materials for fiber-optic cables. Understanding the bonding mechanism between these materials is essential for enhancing the cables' long-term stability. Previously reported experimental studies have suggested that, at the adsorption interface between chrome-plated steel and EAA molecules, two different types of coordination bonds are formed in addition to hydrogen bonding: (O)-C-O-Cr, which is monodentate, and -C-(O-Cr)₂, which is bidentate. Therefore, in the present study, we used density functional th

SUBMITTER: Iwai H 

PROVIDER: S-EPMC12268411 | biostudies-literature | 2025 Jul

REPOSITORIES: biostudies-literature