Makito Takagi

Yokohama City University — Japan

Physics and Astronomy · Physical Sciences

12h-index861citations42works1.92yr avg
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Research Topics

Advanced Chemical Physics Studies(8), Catalytic Processes in Materials Science(6), Force Microscopy Techniques and Applications(6), Nanocluster Synthesis and Applications(6), Machine Learning in Materials Science(5)

Publications42 total

Formation and Activity Mechanisms of a Carbon-Nitride-Supported Single-Atom Catalyst for Photocatalytic Hydrogen Evolution
2025Open Access
Theoretical study of Lewis base passivation of <i>p-</i>type surface defects in I–Br mixed-halide tin perovskites
The Journal of Chemical Physics·2025· 1 cited
Applications of Electron-Positron Correlation-Polarization Potential Method to Positron Binding in Glycine Conformers
Diffusion and defect data, solid state data. Part B, Solid state phenomena/Solid state phenomena·2025Open Access
Metal‐Free Raman Sensing Platforms of Organic Nanowire Arrays Produced by High Energy Charged Particles
Advanced Sensor Research·2025Open Access
Rolling two-dimensional covalent organic framework (COF) sheets into one-dimensional electronic and proton-conductive nanotubes
Proceedings of the National Academy of Sciences·2025· 3 citedOpen Access
Inclusion of gold ions in tiara-like nickel hexanuclear nanoclusters
Nanoscale·2025· 1 citedOpen Access
A theoretical study of the molecular passivation of p-/n-type defects on tin- and germanium-mixed perovskite surfaces using Lewis base/acid
Physical Chemistry Chemical Physics·2025· 1 citedOpen Access
Development of Hessian calculation using the combined plane wave and localized basis sets method and its application to adsorption of a water molecule on Pt(111) surface
Molecular Catalysis·2024· 1 cited
Theoretical and machine learning models for reaction-barrier predictions: acrylate and methacrylate radical reactions
Physical Chemistry Chemical Physics·2024· 2 citedOpen Access
One-dimensional C60 arrays in noncovalent benzidine networks
Carbon·2024· 1 cited
Efficient quantum mechanical minimum free energy path calculation by combining path integral hybrid Monte Carlo and climbing image nudged elastic band methods, and its application to the addition reaction of hydrogen isocyanide to formaldehyde
The Journal of Chemical Physics·2024
Metal single-atom interaction with graphitic C3N4 surface based on density functional theory calculations and linear regression analysis
Chemical Physics·2024
Ultrafine Spatial Modulation of Diazapyrene-Based Two-Dimensional Conjugated Covalent Organic Frameworks
Journal of the American Chemical Society·2024· 16 cited
Development of Hessian Calculation Using the Combined Plane Wave and Localized Basis Sets Method and its Application to Adsorption of a Water Molecule on Pt(111) Surface
SSRN Electronic Journal·2024Open Access
Analysis of the structural H/D isotope effect with an excess proton/deuteron in light/heavy water solvent using path integral molecular dynamics simulations
Bulletin of the Chemical Society of Japan·2023Open Access
Metal Single‐Atom Cocatalyst on Carbon Nitride for the Photocatalytic Hydrogen Evolution Reaction: Effects of Metal Species (Adv. Funct. Mater. 33/2023)
Advanced Functional Materials·2023· 2 citedOpen Access
Theoretical Study of the Molecular Passivation Effect of Lewis Base/Acid on Lead-Free Tin Perovskite Surface Defects
The Journal of Physical Chemistry Letters·2023· 12 cited
Metal Single‐Atom Cocatalyst on Carbon Nitride for the Photocatalytic Hydrogen Evolution Reaction: Effects of Metal Species
Advanced Functional Materials·2023· 90 citedOpen Access
CCDC 2212626: Experimental Crystal Structure Determination
The Cambridge Structural Database·2023Open Access
Improved activity for the oxygen evolution reaction using a tiara-like thiolate-protected nickel nanocluster
Nanoscale·2023· 17 citedOpen Access
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Frequent Co-authors

Masanori Tachikawa(26), Tomomi Shimazaki(17), Satoshi Maeda(15), Tokuhisa Kawawaki(7), Yuichi Negishi(7), Takatsugu Wakahara(6), Chika Hirata(6), Osamu Ito(6), Takayoshi Ishimoto(6), Kazuhito Tsukagoshi(6), Kenichiro Saita(5), Tetsuya Taketsugu(5), Kahori Nagaoka(5), Yoshitaka Matsushita(5), Kun’ichi Miyazawa(5), Takumi Naito(5), Yoshiki Wada(4), Tomomi Shimazaki(4), Kazuko Fujii(4), Shinjiro Yagyu(4)