Kato Koichiro 加藤幸一郎

Researcher Number	30888889
Other IDs
Affiliation (Current)	2025: 九州大学, 工学研究院, 教授
Affiliation (based on the past Project Information) *help	2022 – 2024: 九州大学, 工学研究院, 准教授
Review Section/Research Field	Principal Investigator Transformative Research Areas, Section (II) / Basic Section 35020:Polymer materials-related Except Principal Investigator Basic Section 32010:Fundamental physical chemistry-related
Keywords	Principal Investigator マテリアルズインフォマティクス / 機械学習 / ベイズ最適化 / 第一原理計算 / パーシステントホモロジー / 粗視化シミュレーション / 高分子電解質膜 / ポリマーインフォマティクス / モアレ超格子 / ２次元材料 / ファンデルワールスヘテロ構造 / 2次元材料 / データ科学 … More Except Principal Investigator … More 光化学反応 / 酵素反応 / 蛍光プローブ / 分子動力学計算 / 量子化学計算 Less

高速QM/MM自由エネルギー計算法の開発と新規蛍光プローブの分子設計
- Principal Investigator
  
  八木清
- Project Period (FY)
  2024 – 2026
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 32010:Fundamental physical chemistry-related
- Research Institution
  Institute of Physical and Chemical Research
データ駆動型2.5次元物質モアレ超格子の探索と物性支配因子の抽出Principal Investigator
- Principal Investigator
  
  加藤幸一郎
- Project Period (FY)
  2024 – 2025
- Research Category
  
  Grant-in-Aid for Transformative Research Areas (A)
- Review Section
  
  Transformative Research Areas, Section (II)
- Research Institution
  Kyushu University
Establishment of polymer informatics incorporating polymer-specific hierarchy and search for new electrolytesPrincipal Investigator
- Principal Investigator
  
  加藤幸一郎
- Project Period (FY)
  2023 – 2025
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 35020:Polymer materials-related
- Research Institution
  Kyushu University
Exploring Design Guidelines for Hetero 2.5D Materials by Combining Data Science and First-Principles CalculationsPrincipal Investigator
- Principal Investigator
  
  加藤幸一郎
- Project Period (FY)
  2022 – 2023
- Research Category
  
  Grant-in-Aid for Transformative Research Areas (A)
- Review Section
  
  Transformative Research Areas, Section (II)
- Research Institution
  Kyushu University

All 2024 2023 2022

All Journal Article Presentation

[Journal Article] Polymer Wrapping State Changes at Defect Sites of Locally Functionalized Single-Walled Carbon Nanotubes2024
- Author(s)
  Niidome Yoshiaki、Matsumoto Hiromu、Hamano Ryo、Kato Koichiro、Fujigaya Tsuyohiko、Shiraki Tomohiro
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 128 Issue: 12 Pages: 5146-5155
- DOI
  10.1021/acs.jpcc.3c07692
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-22KJ2489, KAKENHI-PUBLICLY-22H05465, KAKENHI-PROJECT-23K23178, KAKENHI-PROJECT-23K26720
[Journal Article] Pyridine-mediated B?B bond cleavage of tetrahydroxydiboron to synthesize n-doped SWCNTs with long-term air stability2023
- Author(s)
  Tanaka Naoki、Hamasuna Aoi、Yamaguchi Itsuki、Kato Koichiro、Fujigaya Tsuyohiko
- Journal Title
  
  Scientific Reports
  
  Volume: 13 Issue: 1 Pages: 1-7
- DOI
  10.1038/s41598-023-48847-2
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-23K13634, KAKENHI-PUBLICLY-22H05465, KAKENHI-PROJECT-23K26720
[Journal Article] Predicting the anion conductivities and alkaline stabilities of anion conducting membrane polymeric materials: development of explainable machine learning models2023
- Author(s)
  Phua Yin Kan、Fujigaya Tsuyohiko、Kato Koichiro
- Journal Title
  
  Science and Technology of Advanced Materials
  
  Volume: 24 Issue: 1 Pages: 2261833-2261833
- DOI
  10.1080/14686996.2023.2261833
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] 燃料電池用電解質膜を舞台にした機能性ポリマーインフォマティクスの開拓2023
- Author(s)
  加藤幸一郎
- Organizer
  23-1水素・燃料電池材料研究会
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] 機能性ポリマーインフォマティクスに向けた記述子開発2023
- Author(s)
  加藤幸一郎・ポアインカン・東悠貴人・藤ヶ谷剛彦
- Organizer
  第72回高分子討論会
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] Nuclear Magnetic Resonance Chemical Shift as Highly Explainable Chemical Structure Fingerprints for Anion Exchange Membrane Polymers2023
- Author(s)
  Yin Kan Phua, Tsuyohiko Fujigaya, Koichiro Kato
- Organizer
  244th ECS Meeting
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] Efficient Search for Stacking Patterns in van der Waals Heterostructures Using Bayesian Optimization2023
- Author(s)
  Koichiro Kato
- Organizer
  The 66th Fullerenes-Nanotubes-Graphene General Symposium
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-22H05465
[Presentation] データ科学手法によるプロトン交換膜における相分離構造の特徴抽出2023
- Author(s)
  東悠貴人、藤ヶ谷剛彦、加藤幸一郎
- Organizer
  第60回化学関連支部合同九州大会
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] ベイズ最適化によるファンデルワールス積層材料の効率的な積層パターン探索2023
- Author(s)
  チェボムギュ、藤ヶ谷剛彦、加藤幸一郎
- Organizer
  第60回化学関連支部合同九州大会
- Data Source
  KAKENHI-PUBLICLY-22H05465
[Presentation] Unsupervised Machine Learning Method for Virtual Screening of Anion Exchange Membrane (AEM) Polymers2023
- Author(s)
  ポアインカン・藤ヶ谷剛彦・加藤幸一郎
- Organizer
  第34回日本MRS年次大会
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] Toward Functional Polymer Informatics via Coarse-Grained Simulation and Data Science2023
- Author(s)
  Koichiro Kato
- Organizer
  The 13th SPSJ International Polymer Conference
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] データ科学と第一原理計算の融合によるヘテロ積層型２.５次元材料のデザイン指針探索2023
- Author(s)
  加藤幸一郎
- Organizer
  学術変革領域研究(A)「２.５次元物質科学」第１回公開シンポジウム
- Invited
- Data Source
  KAKENHI-PUBLICLY-22H05465
[Presentation] Efficient stacking pattern search for van der Waals hetero structures via Bayesian optimization2023
- Author(s)
  Choi Beomgyu, Tsuyohiko Fujigaya, Koichiro Kato
- Organizer
  MRM2023
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-22H05465
[Presentation] Topological data analysis for feature extraction of phase-separated structures in proton exchange membranes2023
- Author(s)
  Yukito Higashi, Tsuyohiko Fujigaya, Koichiro Kato
- Organizer
  MRM2023
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] Distribution Analysis of Chemical Space for Known Anion Exchange Membrane Polymers2023
- Author(s)
  Yin Kan Phua, Tsuyohiko Fujigaya, Koichiro Kato
- Organizer
  ACS Fall 2023
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] Explainable Machine Learning Protocol for Predicting Ionic Conductivity of Anion Exchange Membranes used in Fuel Cells2023
- Author(s)
  Yin Kan Phua, Tsuyohiko Fujigaya, Koichiro Kato
- Organizer
  The 13th SPSJ International Polymer Conference
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K26720
[Presentation] Search for optimal hetero bilayer structure in 2.5D materials using first-principles calculations and Bayesian optimization2022
- Author(s)
  チェ　ボムギュ、藤ヶ谷　剛彦、加藤　幸一郎
- Organizer
  第64回フラーレン・ナノチューブ・グラフェン総合シンポジウム
- Data Source
  KAKENHI-PUBLICLY-22H05465

1. 八木清 (30401128)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
2. 花岡健二郎 (70451854)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
3. 藤ヶ谷剛彦 (30444863)

# of Collaborated Projects: 1 results

# of Collaborated Products: 8 results
4. 田中直樹

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results

Kato Koichiro 加藤 幸一郎

Research Projects

Research Products

Co-Researchers

高速QM/MM自由エネルギー計算法の開発と新規蛍光プローブの分子設計

Principal Investigator

Project Period (FY)

Research Category

Review Section

Research Institution

データ駆動型2.5次元物質モアレ超格子の探索と物性支配因子の抽出Principal Investigator

Principal Investigator

Project Period (FY)

Research Category

Review Section

Research Institution

Establishment of polymer informatics incorporating polymer-specific hierarchy and search for new electrolytesPrincipal Investigator

Principal Investigator

Project Period (FY)

Research Category

Review Section

Research Institution

Exploring Design Guidelines for Hetero 2.5D Materials by Combining Data Science and First-Principles CalculationsPrincipal Investigator

Principal Investigator

Project Period (FY)

Research Category

Review Section

Research Institution

[Journal Article] Polymer Wrapping State Changes at Defect Sites of Locally Functionalized Single-Walled Carbon Nanotubes2024

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Pyridine-mediated B?B bond cleavage of tetrahydroxydiboron to synthesize n-doped SWCNTs with long-term air stability2023

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Predicting the anion conductivities and alkaline stabilities of anion conducting membrane polymeric materials: development of explainable machine learning models2023

Author(s)

Journal Title

DOI

Data Source

[Presentation] 燃料電池用電解質膜を舞台にした機能性ポリマーインフォマティクスの開拓2023

Author(s)

Organizer

Data Source

[Presentation] 機能性ポリマーインフォマティクスに向けた記述子開発2023

Author(s)

Organizer

Data Source

[Presentation] Nuclear Magnetic Resonance Chemical Shift as Highly Explainable Chemical Structure Fingerprints for Anion Exchange Membrane Polymers2023

Author(s)

Organizer

Data Source

[Presentation] Efficient Search for Stacking Patterns in van der Waals Heterostructures Using Bayesian Optimization2023

Author(s)

Organizer

Data Source

[Presentation] データ科学手法によるプロトン交換膜における相分離構造の特徴抽出2023

Author(s)

Organizer

Data Source

[Presentation] ベイズ最適化によるファンデルワールス積層材料の効率的な積層パターン探索2023

Author(s)

Organizer

Data Source

[Presentation] Unsupervised Machine Learning Method for Virtual Screening of Anion Exchange Membrane (AEM) Polymers2023

Author(s)

Organizer

Data Source

[Presentation] Toward Functional Polymer Informatics via Coarse-Grained Simulation and Data Science2023

Author(s)

Organizer

Data Source

[Presentation] データ科学と第一原理計算の融合によるヘテロ積層型２.５次元材料のデザイン指針探索2023

Author(s)

Organizer

Data Source

[Presentation] Efficient stacking pattern search for van der Waals hetero structures via Bayesian optimization2023

Kato Koichiro 加藤幸一郎