Taniike Toshiaki 谷池俊明

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TANIIKE Toshiaki 谷池俊明

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Researcher Number	50447687
Other IDs
Affiliation (Current)	2025: 北陸先端科学技術大学院大学, 先端科学技術研究科, 教授
Affiliation (based on the past Project Information) *help	2020 – 2024: 北陸先端科学技術大学院大学, 先端科学技術研究科, 教授 2019: 北陸先端科学技術大学院大学, 先端科学技術研究科, 准教授 2016: 北陸先端科学技術大学院大学, 先端科学技術研究科, 准教授 2012 – 2015: 北陸先端科学技術大学院大学, マテリアルサイエンス研究科, 准教授 2009 – 2010: Japan Advanced Institute of Science and Technology, マテリアルサイエンス研究科, 助教
Review Section/Research Field	Principal Investigator Basic Section 27030:Catalyst and resource chemical process-related / Polymer chemistry / Catalyst/Resource chemical process Except Principal Investigator Catalyst/Resource chemical process
Keywords	Principal Investigator 固体触媒 / 遺伝的アルゴリズム / 密度汎関数計算 / 第一原理計算 / 重合触媒 / DFT計算 / ナノ構造不均一性 / 構造分布 / 機械学習ポテンシャル / 構造探索 … More / 構造分布の起源 / Ziegler-Natta触媒 / 非経験的構造探索 / エチレン重合 / オレフィン重合 / 精密設計 / 高分子鎖担持型触媒 / 機能集積 / 協奏的触媒作用 / 遺伝子アルゴリズム / ナノ触媒 / 非経験的構造決定 / コンピュータ予測 / 高精度モデリング / 実験と計算科学の相互支援に基づく触媒設計 / Ziegler-Nattaオレフィン重合触媒 / 触媒・化学プロセス / 化学プロセス / 触媒 / 高分子合成 … More Except Principal Investigator 担体構造の多面的定量 / 構造性能相関 / Ziegler-Nattaオレフィン重合触媒 / Ziegler-Natta触媒 / オレフィン重合 / 多変量解析 / 触媒機能解析 Less

Computational catalysis for heterogeneity based on non-empirical structure exploration of catalyst nanostructuresPrincipal Investigator
- Principal Investigator
  
  谷池俊明
- Project Period (FY)
  2022 – 2024
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 27030:Catalyst and resource chemical process-related
- Research Institution
  Japan Advanced Institute of Science and Technology
Cooperative catalysis and function integration created by random coil structure of polymer chain as nano-sized reactorPrincipal Investigator
- Principal Investigator
  
  Taniike Toshiaki
- Project Period (FY)
  2019 – 2021
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Review Section
  
  Basic Section 27030:Catalyst and resource chemical process-related
- Research Institution
  Japan Advanced Institute of Science and Technology
Ab-initio structure determination of solid catalysts based on genetic algorithmPrincipal Investigator
- Principal Investigator
  
  Taniike Toshiaki
- Project Period (FY)
  2014 – 2016
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Catalyst/Resource chemical process
- Research Institution
  Japan Advanced Institute of Science and Technology
Elucidation of structure-performance relationship in heterogeneous Ziegler-Natta catalysts based on multilateral characterization of support architectures and multivariate analyses
- Principal Investigator
  
  Terano Minoru
- Project Period (FY)
  2013 – 2015
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Catalyst/Resource chemical process
- Research Institution
  Japan Advanced Institute of Science and Technology
Computational design of heterogeneous olefin polymerization catalysts based on high-precision modelingPrincipal Investigator
- Principal Investigator
  
  TANIIKE Toshiaki
- Project Period (FY)
  2012 – 2013
- Research Category
  
  Grant-in-Aid for Young Scientists (B)
- Research Field
  
  Polymer chemistry
- Research Institution
  Japan Advanced Institute of Science and Technology
Design of Heterogeneous Olefin Polymerization Model Catalysts and Experimental & First-Principle Elucidation of Olefin Polymerization MechanismPrincipal Investigator
- Principal Investigator
  
  TANIIKE Toshiaki
- Project Period (FY)
  2009 – 2010
- Research Category
  
  Grant-in-Aid for Young Scientists (B)
- Research Field
  
  Polymer chemistry
- Research Institution
  Japan Advanced Institute of Science and Technology

All 2024 2023 2022 2021 2019 2017 2016 2015 2014 2013 2012 2011 2010 2009 Other

All Journal Article Presentation

[Journal Article] Deciphering the Role of Internal Donors in Shaping Heterogeneous Ziegler-Natta Catalysts Based on Nonempirical Structural Determination2024
- Author(s)
  Joao da Silveira, Hiroki Chikuma, Gentoku Takasao, Toru Wada, Patchanee Chammingkwan, Toshiaki Taniike
- Journal Title
  
  ACS Catalysis
  
  Volume: 14 Issue: 4 Pages: 2300-2312
- DOI
  10.1021/acscatal.3c05480
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23K23133
[Journal Article] Accelerating Non-Empirical Structure Determination of Ziegler-Natta Catalysts with a High-Dimensional Neural Network Potential2023
- Author(s)
  Hiroki Chikuma, Gentoku Takasao, Toru Wada, Patchanee Chammingkwan, Jorg Behler, Toshiaki Taniike
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 127 Issue: 24 Pages: 11683-11691
- DOI
  10.1021/acs.jpcc.3c01511
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Journal Article] Preventing Premature Convergence in Evolutionary Structure Determination of Complex Molecular Systems: Demonstration in Few-Nanometer-Sized TiCl4-Capped MgCl2 Nanoplates2022
- Author(s)
  Takasao Gentoku、Wada Toru、Chikuma Hiroki、Chammingkwan Patchanee、Terano Minoru、Taniike Toshiaki
- Journal Title
  
  The Journal of Physical Chemistry A
  
  Volume: 126 Issue: 31 Pages: 5215-5221
- DOI
  10.1021/acs.jpca.2c02112
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Journal Article] Solution-state NMR study of organic components of industrial Ziegler-Natta catalysts: Effect of by-products on catalyst performance2021
- Author(s)
  Thakur Ashutosh、Chammingkwan Patchanee、Wada Toru、Onishi Rikuo、Kamimura Wataru、Seenivasan Kalaivani、Terano Minoru、Taniike Toshiaki
- Journal Title
  
  Applied Catalysis A: General
  
  Volume: 611 Pages: 117971-117971
- DOI
  10.1016/j.apcata.2020.117971
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19K05149
[Journal Article] Bottom-Up Synthesis of Multi-Grained Ziegler?Natta Catalyst Based on MgO/MgCl2/TiCl4 Core?Shell Catalyst2021
- Author(s)
  Ikeda Tomohiro、Wada Toru、Bando Yusuke、Chammingkwan Patchanee、Taniike Toshiaki
- Journal Title
  
  Catalysts
  
  Volume: 11 Issue: 9 Pages: 1092-1092
- DOI
  10.3390/catal11091092
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-19K05149
[Journal Article] Cooperative Catalysis by Multiple Active Centers of Half-Titanocene Catalyst Integrated in Polymer Random Coil2019
- Author(s)
  Ashutosh Thakur, Ryuki Baba, Toru Wada, Patchanee Chammingkwan, Toshiaki Taniike
- Journal Title
  
  ACS Catalysis
  
  Volume: 9 Issue: 4 Pages: 3648-3656
- DOI
  10.1021/acscatal.9b00214
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19K05149
[Journal Article] High-Throughput Synthesis of Support Materials for Olefin Polymerization Catalyst2017
- Author(s)
  Patchanee Chammingkwan, Minoru Terano, Toshiaki Taniike
- Journal Title
  
  ACS Combinatorial Science
  
  Volume: 印刷中 Issue: 5 Pages: 331-342
- DOI
  10.1021/acscombsci.7b00010
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26420785
[Journal Article] TiCl3/MgCl2モデル触媒を用いたZiegler-Natta触媒の活性点の精密分析2016
- Author(s)
  和田透, 高橋彰吾, 谷池俊明, 寺野稔
- Journal Title
  
  次世代ポリオレフィン総合研究
  
  Volume: 10 Pages: 47-52
- Data Source
  KAKENHI-PROJECT-26420785
[Journal Article] Origin of Chemical Composition of Ethylene/Propylene Copolymer Produced with Ziegler-Natta Catalyst2016
- Author(s)
  Shougo Takahashi, Toru Wada, Patchanee Chammingkwan, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Reaction Engineering
  
  Volume: 印刷中 Issue: 1
- DOI
  10.1002/mren.201600038
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-26420785
[Journal Article] Alternation of Pore Architecture of Ziegler-Natta Catalysts through Modification of Magnesium Ethoxide2015
- Author(s)
  Toshiki Funako, Patchanee Chammingkwan, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Reaction Engineering
  
  Volume: in press Issue: 4 Pages: 325-332
- DOI
  10.1002/mren.201400074
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-25420826
[Journal Article] Addition of second alcohol in magnesium ethoxide synthesis as a way to vary the pore architecture of Ziegler-Natta catalysts2015
- Author(s)
  Toshiki Funako, Patchanee Chammingkwan, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Polyolefins Journal
  
  Volume: in press
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-25420826
[Journal Article] Multilateral Characterization for Industrial Ziegler-Natta Catalysts toward Elucidation of Structure-Performance Relationship2014
- Author(s)
  Toshiaki Taniike, Toshiki Funako, Minoru Terano
- Journal Title
  
  Journal of Catalysis
  
  Volume: 311 Pages: 33-40
- DOI
  10.1016/j.jcat.2013.10.023
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-25420826
[Journal Article] Structure-performance relationship for dialkyldimethoxysilane as external donor in stopped-flow propylene polymerization using Ziegler-Natta catalyst2014
- Author(s)
  Supawadee Poonpong, Sumant Dwivedi, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Chemistry and Physics
  
  Volume: (accepted)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-24750101
[Journal Article] Precise Active Site Analysis for TiCl_3/MgCl_2 Ziegler-Natta Model Catalyst Based on Fractionation and Statistical Methods2013
- Author(s)
  Shougo Takahashi, Toru Wada, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Catalysts
  
  Volume: Vol.3 Pages: 137-147
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-24750101
[Journal Article] Dual-Active-Site Nature of Magnesium Dichloride-Supported Cyclopentadienyl Titanium Chloride Catalysts Switched by an Activator in Propylene Polymerization2013
- Author(s)
  Keisuke Goto, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Chemistry and Physics
  
  Volume: Vol.214 Pages: 1011-1018
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-24750101
[Journal Article] Coadsorption Model for First-Principle Description of Roles of Donors in Heterogeneous Ziegler-Natta Propylene Polymerization2012
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Journal of Catalysis
  
  Volume: Vol.293 Pages: 39-50
- NAID
  120005316221
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-24750101
[Journal Article] 不均一系Ziegler-Natta触媒の性能発現機構に関する密度汎関数計算2010
- Author(s)
  谷池俊明、寺野稔
- Journal Title
  
  触媒 52巻
  
  Pages: 547-552
- NAID
  10027454792
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Role of Dispersion State of Ti Species in Deactivation of MgCl_2-Supported Ziegler-Natta Catalysts2010
- Author(s)
  Toshiaki Taniike, Toru Wada, Iku Kouzai, Shougo Takahashi, Minoru Terano
- Journal Title
  
  Macromolecular Research Vol.18
  
  Pages: 839-844
- NAID
  120003338946
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Effects of Molecular Dispersion State of Surface Ti Species on Ethylene-Propylene Copolymerization with TiCl_3-based Ziegler-Natta Model Catalyst2010
- Author(s)
  Toshiaki Taniike, Shougo Takahashi, Toru Wada, Iku Kouzai, Minoru Terano
- Journal Title
  
  Macromolecular Research
  
  Volume: 18 Pages: 834-838
- NAID
  120003338945
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Similarity and Difference of Active Sites Nature between Basic and Advanced types of MgCl_2-supported Ziegler-Natta Propylene Polymerization Catalysts2010
- Author(s)
  Yuichi Hiraoka, Sang Yull Kim, Ali Dashti, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromol. Reaction Engineering (In press)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Effects of Molecular Dispersion State of Surface Ti Species on Ethylene-Propylene Copolymerization with TiCl_3-based Ziegler-Natta Model Catalyst2010
- Author(s)
  Toshiaki Taniike, Shougo Takahashi, Toru Wada, Iku Kouzai, Minoru Terano
- Journal Title
  
  Macromolecular Research Vol.18
  
  Pages: 834-838
- NAID
  120003338945
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] MgCl_2担持型Ziegler-Natta触媒の表面欠陥構造と高性能活性点に関する密度汎関数計算2010
- Author(s)
  谷池俊明、寺野稔
- Journal Title
  
  次世代ポリオレフィン総合研究 4巻
  
  Pages: 63-72
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] MgCl_2担持型Ziegler-Natta触媒の表面欠陥構造と高性能活性点に関する密度汎関数計算2010
- Author(s)
  谷池俊明, 寺野稔
- Journal Title
  
  次世代ポリオレフィン総合研究
  
  Volume: 4 Pages: 63-72
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] 不均一系Ziegler-Natta触媒の性能発現機構に関する密度汎関数計算2010
- Author(s)
  谷池俊明, 寺野稔
- Journal Title
  
  触媒
  
  Volume: 52 Pages: 547-552
- NAID
  10027454792
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] 次世代の汎用性ポリオレフィンを支える触媒技術2010
- Author(s)
  谷池俊明、寺野稔
- Journal Title
  
  高分子 59巻
  
  Pages: 849-852
- NAID
  10027447683
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] 次世代の汎用性ポリオレフィンを支える触媒技術2010
- Author(s)
  谷池俊明, 寺野稔
- Journal Title
  
  高分子
  
  Volume: 59 Pages: 849-852
- NAID
  10027447683
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Similarity and Difference of Active Sites Nature between Basic and Advanced types of MgCl_2-supported Ziegler-Natta Propylene Polymerization Catalysts2010
- Author(s)
  Yuichi Hiraoka, Sang Yull Kim, Ali Dashti, Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Reaction Engineering Vol.4
  
  Pages: 510-515
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Role of Dispersion State of Ti Species in Deactivation of MgCl_2-Supported Ziegler-Natta Catalysts2010
- Author(s)
  Toshiaki Taniike, Toru Wada, Iku Kouzai, Shougo Takahashi, Minoru Terano
- Journal Title
  
  Macromolecular Research
  
  Volume: 18 Pages: 839-844
- NAID
  120003338946
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] MgCl_2担持型Ziegler-Natta触媒における配位ドナーの立体的柔軟性とプロピレン重合特性に関する計算科学的検討2009
- Author(s)
  谷池俊明、寺野稔
- Journal Title
  
  次世代ポリオレフィン総合研究 3巻
  
  Pages: 75-82
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Propylene Polymerization Performance of Isolated and Aggregated Ti Species Studied Using a Well-Designed TiCl_3/MgCl_2 Ziegler-Natta Model Catalyst2009
- Author(s)
  Toru Wada, Toshiaki Taniike, Iku Kouzai, Shougo Takahashi, Minoru Terano
- Journal Title
  
  Macromolecular Rapid Communications Vol.30
  
  Pages: 887-891
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] A Density Functional Study for Influences of Molecular Flexibility of Donors on Insertion Barrier and Stereoselectivity of Ziegler-Natta Propylene Polymerization2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Chemistry and Physics Vol.210
  
  Pages: 2188-2193
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] MgCl_2担持型Ziegler-Natta触媒における配位ドナーの立体的柔軟性とプロピレン重合特性に関する計算科学的検討2009
- Author(s)
  谷池俊明, 寺野稔
- Journal Title
  
  次世代ポリオレフィン総合研究 3
  
  Pages: 75-82
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] Propylene Polymerization Performance of Isolated and Aggregated Ti Species Studied Using a Well-Designed TiCl_3/MgCl_2 Ziegler-Natta Model Catalyst2009
- Author(s)
  Toru Wada, Toshiaki Taniike, Iku Kouzai, Shougo Takahashi, Minoru Terano
- Journal Title
  
  Macromolecular Rapid Communications 30
  
  Pages: 887-891
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Journal Article] A Density Functional Study for Influences of Molecular Flexibility of Donors on Insertion Barrier and Stereoselectivity of Ziegler-Natta Propylene Polymerization2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Journal Title
  
  Macromolecular Chemistry and Physics 210
  
  Pages: 2188-2193
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Donor-induced support reconstruction and its effects on surface exposure and adsorbate distribution2023
- Author(s)
  Joao Marcos da Silveira, Hiroki Chikuma, Gentoku Takasao, Toshiaki Taniike
- Organizer
  International Symposium on Materials Informatics 2023 -Multidisciplinary approach to olefin polymerization catalysis-
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] Spectroscopic Investigation on pretreatment of Ziegler-Natta catalysts for propylene polymerization2023
- Author(s)
  Kalaivani Seenivasan, Toru Wada, Patchanee Chammingkwan, Toshiaki Taniike
- Organizer
  Asian Polyolefin Workshop 2023 (APO2023)
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] Machine learning-aided structure determination of Ziegler-Natta catalyst with donors2023
- Author(s)
  Joao Marcos da Silveira, Hiroki Chikuma, Gentoku Takasao, Toshiaki Taniike
- Organizer
  First Combined Blue Sky - INCOREP Polyolefin Conference
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] Data-driven approach applied to heterogeneous Ziegler-Natta catalysts2023
- Author(s)
  Toshiaki Taniike
- Organizer
  Asian Polyolefin Workshop 2023 (APO2023)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] Efficient Structure Determination of Ziegler-Natta Catalysts with a High-Dimensional Neural Network Potential and Genetic Algorithm2023
- Author(s)
  Hiroki Chikuma, Gentoku Takasao, Jorg Behler, Toshiaki Taniike
- Organizer
  The 13th SPSJ International Polymer Conference (IPC2023)
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] HTE & data-driven approach for the development of Ziegler-Natta PP catalysts with desired properties2023
- Author(s)
  Toshiaki Taniike, Giuseppe Antinucci
- Organizer
  First Combined Blue Sky - INCOREP Polyolefin Conference
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] Accelerating structure determination of MgCl2/TiCl4 nanoplate for Ziegler-Natta catalysts with a highdimensional neural network potential2023
- Author(s)
  Hiroki Chikuma, Gentoku Takasao, Jorg Behler, Toshiaki Taniike
- Organizer
  First Combined Blue Sky - INCOREP Polyolefin Conference
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] DFT and machine learning combined to study internal donor-induced reconstruction of the heterogeneous Ziegler-Natta catalyst’s structure2023
- Author(s)
  Joao Marcos da Silveira, Hiroki Chikuma, Gentoku Takasao, Toshiaki Taniike
- Organizer
  Asian Polyolefin Workshop 2023 (APO2023)
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] 機械学習ポテンシャルによるZiegler-Natta触媒ナノ構造の非経験的構造決定2022
- Author(s)
  筑間弘樹, 高棹玄徳, Behler Joerg, 谷池俊明
- Organizer
  第52回石油・石油化学討論会
- Data Source
  KAKENHI-PROJECT-23K23133
[Presentation] Origin of Cooperative Ethylene Polymerization Among Multiple Active Centers Integrated in Polymer Random Coils2019
- Author(s)
  Ashutosh Thakur, Minoru Terano, Toshiaki Taniike
- Organizer
  Asian Polyolefin Workshop 2019
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19K05149
[Presentation] Origin of Multicenter Mediated Synergistic Ethylene Polymerization with Polynorbornene-Supported Half-Titanaocene Catalysts2019
- Author(s)
  Ashutosh Thakur, Toshiaki Taniike
- Organizer
  第49回石油・石油化学討論会
- Data Source
  KAKENHI-PROJECT-19K05149
[Presentation] In-Silico Design of Solid Catalysts based on High-Precision Surface Modeling2017
- Author(s)
  Toshiaki Taniike
- Organizer
  JAIST-Tianjin University 2017 Academic Symposium on Information Science & Materials Science
- Place of Presentation
  Ishikawa High-Tech Conference Center (Nomi, Japan)
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] 金クラスターの構造物性相関と溶媒和効果に関する計算化学的検討2016
- Author(s)
  鈴木聖人, 谷池俊明
- Organizer
  日本化学会第96春季年会
- Place of Presentation
  同志社大学京田辺キャンパス（京都府京田辺市）
- Year and Date
  2016-03-24
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] ポリオレフィンの研究開発におけるスループットの向上2016
- Author(s)
  谷池俊明, Chammingkwan Patchanee, 寺野稔
- Organizer
  第11回次世代ポリオレフィン総合研究会
- Place of Presentation
  北陸先端科学技術大学院大学東京サテライト（東京都品川区）
- Year and Date
  2016-08-04
- Invited
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] 計算化学を利用した固体触媒の研究2016
- Author(s)
  谷池俊明
- Organizer
  第10回触媒道場
- Place of Presentation
  まつさき（石川県能美市）
- Year and Date
  2016-08-30
- Invited
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] 密度汎関数計算を用いた金クラスターへの溶媒効果の検討2015
- Author(s)
  鈴木聖人, 相原亮一, 谷池俊明
- Organizer
  平成27年度　日本化学会近畿支部　北陸地区講演会と研究発表会
- Place of Presentation
  金沢大学角間キャンパス（石川県金沢市）
- Year and Date
  2015-11-27
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] 遺伝子アルゴリズムを用いた非経験的構造探索:触媒一次粒子の構造決定へ2015
- Author(s)
  谷池俊明, 相原亮一, 寺野稔
- Organizer
  第10回次世代ポリオレフィン総合研究会
- Place of Presentation
  首都大学東京秋葉原サテライトキャンパス（東京都千代田区）
- Year and Date
  2015-08-06
- Invited
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] Ziegler-Natta触媒粒子の多角的同定2014
- Author(s)
  舟子俊幹, 谷池俊明, 寺野稔
- Organizer
  第4回ポリオレフィン若手研究会
- Place of Presentation
  北陸先端科学技術大学院大学（石川県能美市）
- Data Source
  KAKENHI-PROJECT-25420826
[Presentation] Ziegler-Nattaプロピレン重合用ジエステル系内部ドナーに関する構造性能相関の解明2013
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第62回高分子学会年次大会
- Place of Presentation
  京都国際会館（京都府京都市）
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] 計算化学を利用したZiegler-Natta触媒のオレフィン重合性能の定量的予測2013
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第5回岩澤コンファレンス
- Place of Presentation
  東京
- Year and Date
  2013-10-22
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] Ziegler-Natta触媒用ドナー化合物の非経験的設計への試み2013
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第3回ポリオレフィン研究会若手会
- Place of Presentation
  能美
- Year and Date
  2013-01-25
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] Multivariate Analysis of Structure-Performance Relationship in Heterogeneous Ziegler-Natta Olefin Polymerization2013
- Author(s)
  Toshiaki Taniike, Toshiki Funako, Minoru Terano
- Organizer
  International Conference on the Reaction Engineering of Polyolefins
- Place of Presentation
  The University of Ferrara (Ferrara, Italy)
- Invited
- Data Source
  KAKENHI-PROJECT-25420826
[Presentation] 粒子状マグネシウムアルコキシドの組成がZiegler-Natta触媒構造に及ぼす影響2013
- Author(s)
  舟子俊幹, 谷池俊明, 寺野稔
- Organizer
  第62回高分子学会年次大会
- Place of Presentation
  京都国際会館（京都府京都市）
- Data Source
  KAKENHI-PROJECT-25420826
[Presentation] Pore architecture designs of magnesium alkoxide based olefin polymerization catalysts2013
- Author(s)
  Toshiki Funako, Toshiaki Taniike, Minoru Terano
- Organizer
  International Conference on the Reaction Engineering of Polyolefins
- Place of Presentation
  The University of Ferrara (Ferrara, Italy)
- Data Source
  KAKENHI-PROJECT-25420826
[Presentation] 不均一系Ziegler-Natta触媒の非経験的設計に向けて～ドナーに関する構造性能相関2013
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第43回石油・石油化学討論会
- Place of Presentation
  北九州
- Year and Date
  2013-11-14
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] 不均一系Ziegler-Natta触媒の非経験的設計に向けて～ドナーに関する構造性能相関2013
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第43回石油・石油化学討論会
- Place of Presentation
  北九州国際会議場（福岡県北九州市）
- Invited
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] 計算化学を利用したZiegler-Natta触媒のオレフィン重合性能の定量的予測2013
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第5回岩澤コンファレンス「サステイナブル社会のための最先端触媒化学・表面科学」
- Place of Presentation
  電気通信大学（東京都調布市）
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] Ziegler-Natta触媒用エステル系ドナーの分子構造と性能の相関に関する計算科学的検討2012
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第7回次世代ポリオレフィン総合研究発表会
- Place of Presentation
  東京
- Year and Date
  2012-08-10
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] オレフィン重合触媒の高精度モデリングと非経験的設計2012
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第4回金沢大-JAIST計算物質科学研究会
- Place of Presentation
  金沢
- Year and Date
  2012-09-05
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] Ziegler-Natta触媒用ドナーの非経験的スクリーニング法の開発2012
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第61回高分子学会年次大会
- Place of Presentation
  横浜
- Data Source
  KAKENHI-PROJECT-24750101
[Presentation] Effects of Exchange-Correlation Functionals on Ziegler-Natta Propylene Polymerization2011
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  International Workshop on Computational Approach for Heterogeneous Ziegler-Natta Catalysts
- Place of Presentation
  Ishikawa, Japan
- Year and Date
  2011-02-25
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Chemical Composition Distribution in Slurry Copolymerization of Ethylene and Propylene with Ziegler-Natta Catalysts2011
- Author(s)
  Shougo Takahashi, Toshiaki Taniike, Minoru Terano
- Organizer
  International Workshop on Computational Approach for Heterogeneous Ziegler-Natta Catalysts
- Place of Presentation
  Japan Advanced Institute of Science and Technology (Ishikawa, Japan)
- Year and Date
  2011-02-24
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Effects of Exchange-Correlation Functionals on Ziegler-Natta Propylene Polymerization2011
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  International Workshop on Computational Approach for Heterogeneous Ziegler-Natta Catalysts (invited lecture)
- Place of Presentation
  Japan Advanced Institute of Science and Technology (Ishikawa, Japan)
- Year and Date
  2011-02-25
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Molecular Genesis of Stereospecificity in Heterogeneous Ziegler-Natta Propylene Polymerization2010
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  7th LSP/JAIST International Colloquium on Heterogeneous Ziegler-Natta Catalysts (keynote lecture)
- Place of Presentation
  Hilton Sorrento Palace Conference Centre (Sorrento, Italy)
- Year and Date
  2010-06-24
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] オレフィン重合用Ziegler-Natta触媒の活性点構造と潜在的活性に関する理論的考察2010
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第59回高分子年次大会
- Place of Presentation
  東京
- Year and Date
  2010-05-28
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] First-principle description of Ziegler-Natta propylene polymerization : active site and polymerization mechanism2010
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  Computer Simulation Studies of Soft Materials (invited lecture)
- Place of Presentation
  Japan Advanced Institute of Science and Technology Ishikawa, Japan)
- Year and Date
  2010-07-30
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] MgCl_2担持型Ziegler-Natta触媒の機能発現機構に関する実験科学的・理論化学的検討2010
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第5回次世代ポリオレフィン総合研究発表会
- Place of Presentation
  キャンパス・イノベーションセンター(東京)(招待講演)
- Year and Date
  2010-08-05
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] First-principle description of Ziegler-Natta propylene polymerization2010
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  active site and polymerization mechanism, Computer Simulation Studies of Soft Materials
- Place of Presentation
  Ishikawa, Japan
- Year and Date
  2010-07-30
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Molecular Genesis of Stereospecificity in Heterogeneous Ziegler-Natta Propylene Polymerization2010
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  7th LSP/JAIST International Colloquium on Heterogeneous Ziegler-Natta Catalysts
- Place of Presentation
  Sorrento, Italy
- Year and Date
  2010-06-24
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Stereochemistry of Active Sites Studied by a Novel TiCl_3 Based Ziegler-Natta Model Catalyst2010
- Author(s)
  Toru Wada, Shougo Takahashi, Iku Kouzai, Yuichi Hiraoka, Toshiaki Taniike, Minoru Terano
- Organizer
  7th LSP/JAIST International Colloquium on Heterogeneous Ziegler-Natta Catalysts
- Place of Presentation
  Hilton Sorrento Palace Conference Centre (Sorrento, Italy)
- Year and Date
  2010-06-25
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] MgCl_2担持型Ziegler-Natta触媒の実表面構造と重合性能の発現における原子レベルステップの役割2010
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第59回高分子討論会
- Place of Presentation
  北海道大学(北海道)
- Year and Date
  2010-09-16
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系Ziegler-Natta重合の計算化学的遷移状態分析に基づく活性予測2010
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第40回石油・石油化学討論会
- Place of Presentation
  神戸国際会議場(兵庫)
- Year and Date
  2010-11-26
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] オレフィン重合用Ziegler-Natta触媒の活性点構造と潜在的活性に関する理論的考察2010
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第59回高分子年次大会
- Place of Presentation
  パシフィコ横浜会議センター(神奈川)
- Year and Date
  2010-05-28
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系Ziegler-Natta 重合の計算化学的遷移状態分析に基づく活性予測2010
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第40回石油・石油化学討論会
- Place of Presentation
  神戸
- Year and Date
  2010-11-26
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] MgCl_2担持型Ziegler-Natta触媒の実表面構造と重合性能の発現における原子レベルステップの役割2010
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第59回高分子討論会
- Place of Presentation
  北海道
- Year and Date
  2010-09-16
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] MgCl_2担持型Ziegler-Natta触媒の機能発現機構に関する実験科学的・理論化学的検討2010
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第5回次世代ポリオレフィン総合研究発表会
- Place of Presentation
  東京
- Year and Date
  2010-08-05
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Influences of donors on insertion and chain transfer properties of propylene polymerization with Ziegler-Natta catalysts2009
- Author(s)
  Toshiaki Taniike 、Minoru Terano
- Organizer
  第58回高分子年次大会
- Place of Presentation
  神戸
- Year and Date
  2009-05-28
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Theoretical Explanation of MgCl2-Supported Ziegler-Natta Catalysts based on a "Coadsorption Model" of Donors with Ti Species2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  Invited Youth Talented Talk on Polymer Chemistry
- Place of Presentation
  Beijing, China
- Year and Date
  2009-11-04
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系 Ziegler-Natta プロピレン重合における選択性と活性点近傍の立体的柔軟性に関する第一原理計算2009
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第4回次世代ポリオレフィン総合研究発表会
- Place of Presentation
  東京
- Year and Date
  2009-08-04
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Coadsorption Model for the Catalyst Design of Heterogeneous Ziegler-Natta Catalysts2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  3rd Asian Polyolefin Workshop 2009
- Place of Presentation
  Seoul, Korea
- Year and Date
  2009-10-27
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Relationship between Catalyst Preparation Method and States of Ti Species Investigated by Kinetic and Morphological Approaches2009
- Author(s)
  Yuichi Hiraoka, Toshiaki Taniike, Minoru Terano
- Organizer
  JAIST International Workshop "Molecular Architecture of Heterogeneous Olefin Polymerization Catalysts"
- Place of Presentation
  Ishikawa, Japan
- Year and Date
  2009-12-15
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Coadsorption Model for a First-Principle Explanation of Roles of Donors2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  JAIST International Workshop "Molecular Architecture of Heterogeneous Olefin Polymerization Catalysts"
- Place of Presentation
  Ishikawa, Japan
- Year and Date
  2009-12-15
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系Zigler-Natta 触媒を用いたプロピレン重合におけるルイス塩基化合物の作用機構の理論的解明2009
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第104回触媒討論会
- Place of Presentation
  宮崎
- Year and Date
  2009-09-29
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Theoretical Elucidation of Molecular Behavior of Donors in Ziegler-Natta Propylene Polymerization2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  Advances in Polyolefins 2009 (ACS Division of Polymer Chemistry)
- Place of Presentation
  Santa Rosa, USA
- Year and Date
  2009-09-23
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系Ziegler-Nattaオレフィン重合における活性点のフレキシビリティ2009
- Author(s)
  谷池俊明、寺野稔
- Organizer
  第39回石油・石油化学討論会
- Place of Presentation
  浜松
- Year and Date
  2009-10-22
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Theoretical Explanation of MgCl_2-Supported Ziegler-Natta Catalysts based on a "Coadsorption Model" of Donors with Ti Species2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  Invited Youth Talented Talk on Polymer Chemistry
- Place of Presentation
  Beijing, China
- Year and Date
  2009-11-04
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] First-Principle Explanation on Cooperative Roles of MgCl_2 and Donors in Ziegler-Natta Propylene Polymerization2009
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  LSP/JAIST INTERNATIONAL COLLOQUIUM ON HETEROGENEOUS ZIEGLER-NATTA CATALYSTS
- Place of Presentation
  Naples, Italy
- Year and Date
  2009-06-26
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] Importance of Ti Dispersion States on the Catalytic Performances and the Donor Efficiency using TiCl_3/MgCl_2 Model Catalyst2009
- Author(s)
  Toru Wada, Toshiaki Taniike, Minoru Terano
- Organizer
  JAIST International Workshop "Molecular Architecture of Heterogeneous Olefin Polymerization Catalysts"
- Place of Presentation
  Ishikawa, Japan
- Year and Date
  2009-12-15
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] MgCl_2上孤立TiCl_3種が有するプロピレン重合特性の評価2009
- Author(s)
  和田透, 香西育, 谷池俊明, 寺野稔
- Organizer
  第104回触媒討論会
- Place of Presentation
  宮崎
- Year and Date
  2009-09-29
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系Zigler-Natta触媒を用いたプロピレン重合におけるルイス塩基化合物の作用機構の理論的解明2009
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第104回触媒討論会
- Place of Presentation
  宮崎
- Year and Date
  2009-09-29
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] 不均一系Ziegler-Nattaプロピレン重合における選択性と活性点近傍の立体的柔軟性に関する第一原理計算2009
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第4回次世代ポリオレフィン総合研究発表会
- Place of Presentation
  東京
- Year and Date
  2009-08-04
- Data Source
  KAKENHI-PROJECT-21750119
[Presentation] First-Principle Molecular Design of Donors in Ziegler-Natta Olefin Polymerization
- Author(s)
  Toshiaki Taniike, Minoru Terano
- Organizer
  11th International Seminar on Polymer Science & Technology
- Place of Presentation
  Tehran, Iran
- Year and Date
  2014-10-06 – 2014-10-09
- Invited
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] 実験・計算化学の相互利用によるアルコキシシラン系外部ドナーの構造性能相関の解明
- Author(s)
  谷池俊明, 寺野稔
- Organizer
  第9回次世代ポリオレフィン総合研究会
- Place of Presentation
  首都大学東京秋葉原サテライトキャンパス（東京都千代田区）
- Year and Date
  2014-08-07 – 2014-08-08
- Invited
- Data Source
  KAKENHI-PROJECT-26420785
[Presentation] 多変量解析を用いたZiegler-Natta触媒の構造性能相関解明
- Author(s)
  谷池俊明, 舟子俊幹, 寺野稔
- Organizer
  第114回触媒討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県広島市）
- Year and Date
  2014-09-25 – 2014-09-27
- Data Source
  KAKENHI-PROJECT-25420826
[Presentation] 遺伝子アルゴリズムと第一原理計算の併用による金ナノクラスターの非経験的構造決定
- Author(s)
  相原亮一, 谷池俊明
- Organizer
  第114回触媒討論会
- Place of Presentation
  広島大学東広島キャンパス（広島県広島市）
- Year and Date
  2014-09-25 – 2014-09-27
- Data Source
  KAKENHI-PROJECT-26420785

1. Terano Minoru (90251975)

# of Collaborated Projects: 1 results

# of Collaborated Products: 8 results
2. THAKUR Ashutosh (80836833)

# of Collaborated Projects: 1 results

# of Collaborated Products: 4 results

Taniike Toshiaki 谷池 俊明

TANIIKE Toshiaki 谷池 俊明

Research Projects

Research Products

Co-Researchers

Computational catalysis for heterogeneity based on non-empirical structure exploration of catalyst nanostructuresPrincipal Investigator

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Cooperative catalysis and function integration created by random coil structure of polymer chain as nano-sized reactorPrincipal Investigator

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Ab-initio structure determination of solid catalysts based on genetic algorithmPrincipal Investigator

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Elucidation of structure-performance relationship in heterogeneous Ziegler-Natta catalysts based on multilateral characterization of support architectures and multivariate analyses

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Computational design of heterogeneous olefin polymerization catalysts based on high-precision modelingPrincipal Investigator

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Design of Heterogeneous Olefin Polymerization Model Catalysts and Experimental & First-Principle Elucidation of Olefin Polymerization MechanismPrincipal Investigator

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[Journal Article] Deciphering the Role of Internal Donors in Shaping Heterogeneous Ziegler-Natta Catalysts Based on Nonempirical Structural Determination2024

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[Journal Article] Accelerating Non-Empirical Structure Determination of Ziegler-Natta Catalysts with a High-Dimensional Neural Network Potential2023

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[Journal Article] Preventing Premature Convergence in Evolutionary Structure Determination of Complex Molecular Systems: Demonstration in Few-Nanometer-Sized TiCl4-Capped MgCl2 Nanoplates2022

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[Journal Article] Solution-state NMR study of organic components of industrial Ziegler-Natta catalysts: Effect of by-products on catalyst performance2021

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[Journal Article] Bottom-Up Synthesis of Multi-Grained Ziegler?Natta Catalyst Based on MgO/MgCl2/TiCl4 Core?Shell Catalyst2021

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[Journal Article] Cooperative Catalysis by Multiple Active Centers of Half-Titanocene Catalyst Integrated in Polymer Random Coil2019

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Taniike Toshiaki 谷池俊明

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