K
Kouji Inagaki
Researcher at Osaka University
Publications - 53
Citations - 1244
Kouji Inagaki is an academic researcher from Osaka University. The author has contributed to research in topics: Adsorption & Density functional theory. The author has an hindex of 12, co-authored 49 publications receiving 1078 citations.
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Adsorption of hydrogen fluoride on SiC surfaces: A density functional theory study
TL;DR: In this article, first-principles reaction path simulations of hydrogen fluoride (HF) adsorption at steps and terraces of 3C-silicon carbide (SiC) (111) surfaces were carried out to investigate initial processes in catalyst-referred etching (CARE).
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Geometry and Conduction of an Infinite Single-Row Gold Wire
Shigeru Tsukamoto,Tomoya Ono,Yoshitaka Fujimoto,Kouji Inagaki,Hidekazu Goto,Hidekazu Goto,Kikuji Hirose +6 more
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First-principles molecular-dynamics calculations and STM observations of dissociative adsorption of Cl2 and F2 on Si(001) surface
Hiromi Okada,Kouji Inagaki,Hidekazu Goto,Hidekazu Goto,Katsuyoshi Endo,Kikuji Hirose,Yuzo Mori +6 more
TL;DR: In this paper, first-principles molecular-dynamics (FPMD) calculations and scanning tunneling microscopy (STM) observations were used to study the dissociative adsorption process of halogen molecules on the Si(0 0 1) surface.
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First-principles theoretical study of hydrolysis of stepped and kinked Ga-terminated GaN surfaces
TL;DR: It is found that the activation barrier of H2O dissociation at the kinked site of the Ga-terminated GaN surface is about 0.8 eV, which is significantly lower than that at the stepped site of about 1.2 eV and is consistent with the experimental observation where a step-terrace structure is observed after the etching process.
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Experimental and computational studies on ruthenium(ii) bis-diimine complexes of N,N'-chelate ligands: the origin of changes in absorption spectra upon oxidation and reduction.
Siew San Tan,Susumu Yanagisawa,Kouji Inagaki,Mohammad B. Kassim,Mohammad B. Kassim,Yoshitada Morikawa +5 more
TL;DR: Although both complexes show subtle differences in behaviour, their spectral changes are distinct, and the origin of changes in their absorption spectra upon oxidation and reduction is successfully interpreted.