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Co-authoring Researcher

Tsuneki Hideaki
RE技研
バイオマス変換, hydrogen production, ammonia synthesis, ゼオライト, 気相脱水反応, 酸塩基触媒, 気相酸化反応, 触媒化学, 反応工学
Ogo Shuhei
Kochi University
Electrochemistry, Hydrothermal chemistry, Catalytic chemistry
Nakai Hiromi
Waseda University Faculty of Science and Engineering School of Advanced Science and Engineering
物理化学, Theoretical Chemistry, Quantum Chemistry, Electronic State Theory, Molecular Simulation, Machine Learning

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J-GLOBAL ID：201601005198397887 Update date: Mar. 04, 2025

Ishikawa Atsushi

Affiliation and department：
Job title： Associate professor
Homepage URL (1)： https://ishikawa-group.github.io/

Research field (1)： Green/sustainable/environmental chemistry

Research theme for competitive and other funds (5)：

2022 - 2025 超精密表面化学反応の開発と炭素ナノ構造体の磁性開拓
2016 - 2018 Temperature and pressure dependent chemical kinetics from ab initio electronic structure calculation and its application to heterogeneous catalysts
2015 - 2018 Development of accurate quantumchemical computation method for condensed-phase therodynamic properies
2014 - 2016 Large scale theoretical method intended for graphene and heterographenes for material science
2009 - 2010 遷移金属錯体の化学反応ダイナミクス:手法の開発と動的挙動の解明

Papers (59)：

Kaoru Hisama, Atsushi Ishikawa, Susan Menez Aspera, Michihisa Koyama. Theoretical Catalyst Screening of Multielement Alloy Catalysts for Ammonia Synthesis Using Machine Learning Potential and Generative Artificial Intelligence. The Journal of Physical Chemistry C. 2024
Tetsuro Morooka, Tamao Shishido, Ruttala Devivaraprasad, Ganesan Elumalai, Makoto Aoki, Tetsuroh Shirasawa, Takuya Nakanishi, Atsushi Ishikawa, Toshihiro Kondo, Takuya Masuda. Potential-Dependent and Face Orientation-Dependent Electrochemical Oxidative Desorption Behavior of Sulfur Species Adsorbed on Platinum Single-Crystal Surfaces. The Journal of Physical Chemistry C. 2024
Donglin Li, Sota Seki, Atsushi Ishikawa, Kenichiro Omoto, Kazuma Yasuhara, Gwénaël Rapenne, Shigeki Kawai. Procrystalline Self-Assembly of Desymmetrized Pentaphenylcyclopentadiene. The Journal of Physical Chemistry Letters. 2024
Atsushi Ishikawa. Machine-learning descriptor search on the density of states profile of bimetallic alloy systems and comparison with the d-band center theory. Journal of Computational Chemistry. 2024
Kewei Sun, Atsushi Ishikawa, Ryota Itaya, Yuichiro Toichi, Takuya Yamakado, Atsuhiro Osuka, Takayuki Tanaka, Kazuyuki Sakamoto, Shigeki Kawai. On-Surface Synthesis of Polyene-Linked Porphyrin Cooligomer. ACS Nano. 2024

MISC (6)：

Lectures and oral presentations (23)：

マグネシウム中の合金元素近傍の局所格子歪と化学結合
(日本金属学会講演概要(CD-ROM) 2015)
原子化エネルギーから見た高圧下でのシリカの相転移と化学結合
(DV-Xα研究協会会報 2015)
量子化学計算による気体分子の溶解度:調和溶媒和モデルによる検討
(日本コンピュータ化学会年会講演予稿集 2015)
原子化エネルギーから見た高圧下のSiO<sub>2</sub>とMgSiO<sub>3</sub>の化学結合
(日本金属学会講演概要(CD-ROM) 2014)
量子化学計算による金属クラスター触媒反応に対する担体効果の研究
(触媒討論会講演予稿集 2014)

Professional career (1)：

Work history (2)：

2023/04 - 現在 Tokyo Institute of Technology School of Environment and Society Associate professor
2017/04 - 2023/03 National Institute for Materials Science GREEN Senior researcher

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