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Journal of Chemical Theory and Computation
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February 24, 2025
Machine Learning Model to Predict Free-Energy Landscape and Position-Dependent Diffusion Constant to Extend the Scale of Dynamic Monte Carlo Simulations
Tetsuro Nagai, Nobuaki Kikkawa, Ryosuke Jinnouchi, et al.
The Journal of Physical Chemistry Letters
|
April 5, 2023
Proton Transport in Perfluorinated Ionomer Simulated by Machine-Learned Interatomic Potential
Ryosuke Jinnouchi, Saori Minami, Ferenc Karsai, et al.
The Journal of Chemical Physics
|
October 3, 2024
Density isobar of water and melting temperature of ice: Assessing common density functionals
Pablo Montero de Hijes, Christoph Dellago, Ryosuke Jinnouchi, et al.
The Journal of Physical Chemistry Letters
|
August 14, 2020
On-the-Fly Active Learning of Interatomic Potentials for Large-Scale Atomistic Simulations
Ryosuke Jinnouchi, Kazutoshi Miwa, Ferenc Karsai, et al.
Nature Nanotechnology
|
January 22, 2021
Challenges in applying highly active Pt-based nanostructured catalysts for oxygen reduction reactions to fuel cell vehicles
Kensaku Kodama, Tomoyuki Nagai, Akira Kuwaki, et al.
The Journal of Chemical Physics
|
March 17, 2026
Local diffusion analysis using square displacement averaged in subspace
Nobuaki Kikkawa, Ryosuke Jinnouchi, Tetsuro Nagai, et al.
The Journal of Chemical Physics
|
March 20, 2024
Comparing machine learning potentials for water: Kernel-based regression and Behler-Parrinello neural networks
Pablo Montero de Hijes, Christoph Dellago, Ryosuke Jinnouchi, et al.
Nature Communications
|
April 22, 2020
CO oxidation activity of non-reducible oxide-supported mass-selected few-atom Pt single-clusters
Atsushi Beniya, Shougo Higashi, Nobuko Ohba, et al.
ACS Applied Materials & Interfaces
|
January 28, 2026
Structural Factors of Platinum-Supported Carbon Influencing Ionomer Adsorption in Fuel Cell Catalyst Inks
Shuhei Yoshino, Masashi Harada, Naoki Hasegawa, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 12, 2018
Band bending and dipole effect at interface of metal-nanoparticles and TiO<sub>2</sub> directly observed by angular-resolved hard X-ray photoemission spectroscopy
Shunsuke Sato, Keita Kataoka, Ryosuke Jinnouchi, et al.
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of 4
Search research articles
Search
Showing results (21-30 of 31) with videos related to
Sort By:
Page
of 4
Journal of Chemical Theory and Computation
|
February 24, 2025
Machine Learning Model to Predict Free-Energy Landscape and Position-Dependent Diffusion Constant to Extend the Scale of Dynamic Monte Carlo Simulations
Tetsuro Nagai, Nobuaki Kikkawa, Ryosuke Jinnouchi, et al.
The Journal of Physical Chemistry Letters
|
April 5, 2023
Proton Transport in Perfluorinated Ionomer Simulated by Machine-Learned Interatomic Potential
Ryosuke Jinnouchi, Saori Minami, Ferenc Karsai, et al.
The Journal of Chemical Physics
|
October 3, 2024
Density isobar of water and melting temperature of ice: Assessing common density functionals
Pablo Montero de Hijes, Christoph Dellago, Ryosuke Jinnouchi, et al.
The Journal of Physical Chemistry Letters
|
August 14, 2020
On-the-Fly Active Learning of Interatomic Potentials for Large-Scale Atomistic Simulations
Ryosuke Jinnouchi, Kazutoshi Miwa, Ferenc Karsai, et al.
Nature Nanotechnology
|
January 22, 2021
Challenges in applying highly active Pt-based nanostructured catalysts for oxygen reduction reactions to fuel cell vehicles
Kensaku Kodama, Tomoyuki Nagai, Akira Kuwaki, et al.
The Journal of Chemical Physics
|
March 17, 2026
Local diffusion analysis using square displacement averaged in subspace
Nobuaki Kikkawa, Ryosuke Jinnouchi, Tetsuro Nagai, et al.
The Journal of Chemical Physics
|
March 20, 2024
Comparing machine learning potentials for water: Kernel-based regression and Behler-Parrinello neural networks
Pablo Montero de Hijes, Christoph Dellago, Ryosuke Jinnouchi, et al.
Nature Communications
|
April 22, 2020
CO oxidation activity of non-reducible oxide-supported mass-selected few-atom Pt single-clusters
Atsushi Beniya, Shougo Higashi, Nobuko Ohba, et al.
ACS Applied Materials & Interfaces
|
January 28, 2026
Structural Factors of Platinum-Supported Carbon Influencing Ionomer Adsorption in Fuel Cell Catalyst Inks
Shuhei Yoshino, Masashi Harada, Naoki Hasegawa, et al.
Physical Chemistry Chemical Physics : PCCP
|
April 12, 2018
Band bending and dipole effect at interface of metal-nanoparticles and TiO<sub>2</sub> directly observed by angular-resolved hard X-ray photoemission spectroscopy
Shunsuke Sato, Keita Kataoka, Ryosuke Jinnouchi, et al.
Page
of 4