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YAMABE Shinichi  山邊 信一

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… Alternative Names

山邊 信一  ヤマベ シンイチ

YAMABE Shininch  山邊 信一

YAMABE Sin-ichi  山邊 信一

山辺 信一

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Researcher Number 00109117
Other IDs
Affiliation (based on the past Project Information) *help 2009: 奈良教育大学, 教育学部, 教授
1992 – 2007: 奈良教育大学, 教育学部, 教授
1989 – 1990: 奈良教育大学, 教育学部, 助教授
1987: 奈良教大, 教育, 助教授
Review Section/Research Field
Principal Investigator
Science and Engineering / Synthetic chemistry / Physical chemistry
Except Principal Investigator
Organic chemistry / Physical chemistry / Physical chemistry / 工業物理化学 / 物質変換 / 教科教育 / 有機化学一般 / 構造化学 / Applied materials
Keywords
Principal Investigator
QCLDB / 水素結合 / 反応機構 / セレノシリルエテン / ルイス酸 / シクロプロパン化 / Hydrogen bond / Disilene / Density functional theory / Friedel-Crafts Reaction … More / Computational chemistry / Reaction mechanism / Organic chemistry / エナンチオ選択的付加 / 芳香族求電子置換反応 / ベンジル-ベンジル酸転位 / Beckmann転位 / 水素1,5-シフト / ジシレン / 密度汎関数法 / フリーデルクラフツ反応 / 計算機化学 / 有機化学 / World Wide Web / Ab initio Wavefunction / Data Input System / Management Systems / Retrieval Program / Qyantum Chemistry / Literature Data Base / 非経験的波動関数 / データ査読収集システム / 管理システム / 検索プログラム / 量子化学 / 文献データベース / アルデヒド / 密度汎関数 / アルドール縮合 / オキセタン / ケテン / 5員環化化合物 / 閉環反応 / エンイン / [2+1]環化付加 / 分子軌道計算 / ケイ素1、2-転位 … More
Except Principal Investigator
量子化学 / Quantum Chemistry / ケテン / 非経験的分子軌道法 / 分子軌道法 / QCLDB II / QCLDB / 軌道相互作用 / 量子化学計算 / ketene / 分子軌道理論 / C=O結合 / WWW / データベース / ジエン / 金属錯体 / electronic structure theory / 軌道相互作用理論 / 電子構造理論 / 遷移状態構造 / ポテンシャル面 / 一酸化炭素 / 酸化マグネシウム / 文献データベース / 電子構造論 / Density Functional Theory Method / Ab Initio Molecular Orbital Method / Quantum Chemistry Calculation / New Quantum Chemistry Literature Data Base / 密度汎関数法 / 新量子化学文献データベース / Information Science / Information Search / Ab initio Calculation / Non-empirical Molecular Orbital Method / Database / Quantum Chemistry Literature Database / ab initio method / 情報科学 / 情報検索 / ab initio計算 / 量子化学文献データベース / zwitterion / UV-vis / NMR / α-methyleneoxetanee / cycloaddition / olefin / クライオスタット / 低温モニター / オキセタン / 環化付加 / 双性イオン / α-メチレンオキセタン / オレフィン / 反応機構 / cyclobutanone / α-methylenedihydropyran / C=O bond / [4 + 2] cycloaddition / [2 + 2] cycloaddition / 1,3-dienes / non-recognition / 区別 / 素過程 / 不飽和 / 共役 / シクロプタノン / シクロブタノン / α-メチレンジヒドロピラン / [2+2]環化付加 / [4+2]環化付加 / 1,3-ジエン / 不認識 / Relational Data / Internet / Ab initio / Data Base / Literature Data Base / 非経験的分子軌道 / リレーショナルデータベース / インターネット / 非経験分子軌道法 / Understanding support / Multimedia / Network / Visualization / Home study material / Arithmetic material / Science material / 授業研究 / 教材開発 / 理解支援 / マルチメディア / ネットワーク / 視覚化 / 家庭科教材 / 算数教材 / 理科教材 / metal complexes / optical activity / facial selectivities / chemical reactivities / transition structures / reaction intermediates / molecular orbital theory / 付加環化反応 / キラリティー / 反応性評価 / 電子構造 / 光学活性 / 面選択性 / 化学反応性 / 反応中間体 / Molecular Orbital Theory / Quantum Organic Chemistry / Organic Orbital Theory / Frontier Orbital Theory / 有機軌道論 / 量子有機化学 / フロンティア軌道理論 / 福井理論 / [4+2] Cycloaddition / Diene / Ketene / Metal Complex / Tropothione S-sulfide / Tropothione / Triene / Ring Opening Reaction / 双極子モーメント / チオスルフィン / π電子系化合物 / トリポチオン / 水銀錯体 / 赤外スペクトル / トロポン / [4【symmetry】2]環化付加 / トロポチオンS-スルフィド / トロポチオン / トリエン / 環開裂反応 / Sulfine / S-Oxide / [7]Annulenimine / Cage Molecule / Cycloaddition / Fulvene / [7]Annulenethione / [7]Annulene / 環状付加反応 / アヌレンイミン / アヌレンチオン / スルフィン / S-オキシド / [7]アヌレンイミン / カゴ型化合物 / 環化付加反応 / フルベン / [7]アヌレンチオン / [7]アヌレン / orbital interaction theory / transition metal / heavy elements / excited state / chemical reaction / 反応性理論 / 遷移金属元素 / 高周期典型元素 / 励起状態 / 電子理論 / 化学反応 / Polymers / Transition Metal Complexes / Solvent Effect / Reaction Dynamics / Transition Structures / Potential Surfaces / MO Theory / Theory of Reactions / 化学反応性理論 / 励起分子の電子構造 / 遷移金属錯体触媒 / 反応の遷移状態 / 反応設計 / イオンチャネル / ファンデルワ-ルス錯体 / 遷移金属錯体 / 触媒作用 / 素反応過程 / 高分子 / 遷移金属化合物 / 溶媒効果 / 反応動力学 / 化学反応理論 / Step sites / Alkaliearth oxides / Carbon monoxide absorbate / Magnesium oxide surfaces / Oxygen-isotope exchange / ステップサイト / MgO微粒子表面 / 一酸化炭素吸着 / ステップ サイト / アルカリ土類酸化物 / 一酸化炭素吸着種 / 酸化マグネシウム表面 / 酸素同位体交換 / 熱脱離ガス分析 / 交換反応 / 吸着 / ESR / 超高眞空 / 文献収集 / 非経験的計算 / 文献検索 / データーベース / 理論化学 / QCDB / 自動収集システム / 文献収集活動 / 計算科学 / システム開発 / 収集・査読 / 計算化学 / 文献データーベース / 分子設計 / 高選択的反応制御 / 有機反応機構 / 分子軌道計算 Less
  • Research Projects

    (21 results)
  • Research Products

    (44 results)
  • Co-Researchers

    (50 People)
  •  有機化学反応での水分子集団の制御・支配力-新規な反応機構の確立に向けてPrincipal Investigator

    • Principal Investigator
      山邊 信一
    • Project Period (FY)
      2007
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Review Section
      Science and Engineering
    • Research Institution
      Nara University of Education
  •  Spontaneous and Perpetual Development of a New Quantum-Chemistry Data Base System

    • Principal Investigator
      HADA Masahiko
    • Project Period (FY)
      2007 – 2009
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Physical chemistry
    • Research Institution
      Tokyo Metropolitan University
  •  Design of metal-catalyzed synthetic reactions based on theoretical calculationsPrincipal Investigator

    • Principal Investigator
      YAMABE Shinichi
    • Project Period (FY)
      2005 – 2006
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Synthetic chemistry
    • Research Institution
      Nara University of Education
  •  Development of continually viable quantum chemistry literature date base

    • Principal Investigator
      KOGA Nobuaki
    • Project Period (FY)
      2004 – 2006
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Physical chemistry
    • Research Institution
      Nagoya University
  •  金属錯体を経由する合成反応の理論計算に基づいた設計Principal Investigator

    • Principal Investigator
      山邊 信一 (山辺 信一)
    • Project Period (FY)
      2001
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas (A)
    • Review Section
      Science and Engineering
    • Research Institution
      Nara University of Education
  •  Development of New Quantum Chemistry Literature Database System

    • Principal Investigator
      MATSUSHITA Toshio
    • Project Period (FY)
      2001 – 2003
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Physical chemistry
    • Research Institution
      Osaka City University
  •  Breakthrough of an established theory on organic reaction mechanism

    • Principal Investigator
      MACHIGUCHI Takehisa
    • Project Period (FY)
      2000 – 2002
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      物質変換
    • Research Institution
      Saitama University
  •  金属錯体を経由する合成反応の理論計算に基づいた設計Principal Investigator

    • Principal Investigator
      山辺 信一
    • Project Period (FY)
      1999
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas (A)
    • Review Section
      Science and Engineering
    • Research Institution
      Nara University of Education
  •  Study and development of understanding support systems for science and home-study through network multi-media

    • Principal Investigator
      MATSUMURA Takeko
    • Project Period (FY)
      1998 – 1999
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      教科教育
    • Research Institution
      Nara University of Education
  •  Development of the Quantum Chemistry Literature Data Base System for Internet

    • Principal Investigator
      YABUSHITA Satoshi
    • Project Period (FY)
      1998 – 2000
    • Research Category
      Grant-in-Aid for Scientific Research (B).
    • Research Field
      Physical chemistry
    • Research Institution
      Keio University
  •  An Innovation in Ketene Chemistry

    • Principal Investigator
      MACHIGUCHI Takahisa
    • Project Period (FY)
      1998 – 1999
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Organic chemistry
    • Research Institution
      Saitama University
  •  Organic Orbital Theory-Fundamentals and Applications

    • Principal Investigator
      TOMODA Shuji
    • Project Period (FY)
      1996
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Organic chemistry
    • Research Institution
      The University of Tokyo
  •  Analyzes and Designs of Local Electronic Structures of Molecules and Chemical Reactions

    • Principal Investigator
      FUJIMOTO Hiroshi
    • Project Period (FY)
      1996 – 1997
    • Research Category
      Grant-in-Aid for Scientific Research (A)
    • Research Field
      工業物理化学
    • Research Institution
      KYOTO UNIVERSITY
  •  有機化学の軌道理論

    • Principal Investigator
      FUJIMOTO Hiroshi
    • Project Period (FY)
      1995
    • Research Category
      Grant-in-Aid for Co-operative Research (B)
    • Research Field
      工業物理化学
    • Research Institution
      Kyoto University
  •  Development of the computer-assisted management systems for Quantum Chemistry Literature Data BasePrincipal Investigator

    • Principal Investigator
      YAMABE Sin-ichi
    • Project Period (FY)
      1995 – 1997
    • Research Category
      Grant-in-Aid for Scientific Research (A)
    • Research Field
      Physical chemistry
    • Research Institution
      Nara University of Education, Department of Education
  •  Study on Synthesis and Properties of Novel pi System Compounds

    • Principal Investigator
      MACHIGUCHI Takahisa
    • Project Period (FY)
      1995 – 1997
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Organic chemistry
    • Research Institution
      Saitama University
  •  Electronic Structure theories for Chemical Reactions

    • Principal Investigator
      KATO Shigeki
    • Project Period (FY)
      1992 – 1995
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Research Institution
      Kyoto University
  •  The Chemistry of Novel[7]Annulene Compounds

    • Principal Investigator
      MACHIGUCHI Takahisa
    • Project Period (FY)
      1992 – 1993
    • Research Category
      Grant-in-Aid for General Scientific Research (C)
    • Research Field
      有機化学一般
    • Research Institution
      Saitama University
  •  Molecular Theory of Electronic Structure Design and Control of Reactions and Its Application

    • Principal Investigator
      FUJIMOTO Hiroshi
    • Project Period (FY)
      1990 – 1992
    • Research Category
      Grant-in-Aid for Co-operative Research (A)
    • Research Field
      構造化学
    • Research Institution
      KYOTO UNIVERSITY
  •  Study of Oxygen-Exchange Mechanism Between Fine Grain Surfaces of Alkali Earth Oxides and CO Gas

    • Principal Investigator
      HUZIMURA Ryoiytiro
    • Project Period (FY)
      1989 – 1990
    • Research Category
      Grant-in-Aid for General Scientific Research (C)
    • Research Field
      Applied materials
    • Research Institution
      Nara University of Education
  •  超高眞空ESRによるアルカリ土類酸化物表面の反応中心の研究

    • Principal Investigator
      HUZIMURA Ryoiytiro
    • Project Period (FY)
      1987
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Research Institution
      Nara University of Education

All 2010 2007 2006 2005 Other

All Journal Article Presentation

  • [Journal Article] The Role of Hydrogen Bonds in Baeyer-Villiger Reactions.2007

    • Author(s)
      Yamabe, S.Yamazaki, S.
    • Journal Title

      J. Org. Chem. 72

      Pages: 3031-3041

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A Reaction of o-Benzyne with Tropothione Involving Biradical Processes.2007

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Org. Chem. 72 (in press)

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Syntheses, Characterization, and DFT Investigations of Ir(III) Tolylterpyridine Complexes.2007

    • Author(s)
      Naokazu Yoshikawa, Shinichi Yamabe, Nobuko Kanehisa, Yasushi Kai, Hiroshi Takashima, Keiichi Tsukahara
    • Journal Title

      Eur. J. Inorg. Chem.

      Pages: 1911-1919

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A Reaction of o-Benzyne with Tropothione Involving Biradical Processes2007

    • Author(s)
      S Yamabe
    • Journal Title

      J. Org. Chem. 72

      Pages: 2832-2841

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029032
  • [Journal Article] A Reaction of o-Benzyne with Tropothione Involving Biradical Processes.2007

    • Author(s)
      Shinichi Yamabe, Tsutomu Minato, Akihiro Ishiwata, Osamu Irinamihira, Takahisa Machiguchi
    • Journal Title

      J. Org. Chem. 72

      Pages: 2832-2841

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Theoretical Study of the Role of Solvent H_2O in Neopentyl and Pinacol Rearrangements.2007

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Comput. Chem. 28

      Pages: 1561-1571

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A Reaction of o-Benzyne with Tropothione Involving Biradical Processes.2007

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Org. Chem. 72

      Pages: 2832-2841

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] How Many Elementary Processes Are Involved in Base- and Acidpromoted Aldol Condensations?2007

    • Author(s)
      S Yamabe
    • Journal Title

      Eur. J. Org. Chem.

      Pages: 6070-6077

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029032
  • [Journal Article] Theoretical Study of the Role of Solvent H_2O in Neopentyl and Pinacol Rearrangements.2007

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Comput. Chem. in press.

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] The Role of Hydrogen Bonds in Baeyer-Villiger Reactions.2007

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Org. Chem. 72

      Pages: 3031-3041

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] The Role of Hydrogen Bonds in Baeyer-Villiger Reactions2007

    • Author(s)
      S. Yamabe
    • Journal Title

      J. Org. Chem. 72

      Pages: 3031-3041

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029032
  • [Journal Article] The Role of Hydrogen Bonds in Baeyer-Villiger Reactions.2007

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Org. Chem. 72 (in press)

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Theoretical study of the role of solvent H_2O in neopentyl and pinacol rearrangements2007

    • Author(s)
      S. Yamabe
    • Journal Title

      J. Comput. Chem. 28

      Pages: 1561-1571

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029032
  • [Journal Article] Theoretical Study of the Role of Solvent H_2O in Neopentyl and Pinacol Rearrangements.2007

    • Author(s)
      Yamabe, S.Tsuchida, N.Yamazaki, S.
    • Journal Title

      J. Comput. Chem. 28

      Pages: 1561-1571

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Active Role of Hydrogen Bonds in Rupe and Meyer-Schuster Rearrangements.2006

    • Author(s)
      Yamabe, S.
    • Journal Title

      J. Chem. Theory Comput. 2

      Pages: 1379-1387

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Syntheses, characterization, and DFT investigation of new mononuclear acetonitrile- and chloro-ruthenium(H) terpyridine complexes.2006

    • Author(s)
      Naokazu Yoshikawa, Shinichi Yamabe, Nobuko Kanehisa, Yasushi Kai, Hiroshi Takashima, Keiichi Tsukahara
    • Journal Title

      Inorganica Chimica Acta 359

      Pages: 4585-4593

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A FMO-Controlled Reaction Path in the Benzil-Benzilic Acid Rearrangement.2006

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Org. Chem. 71

      Pages: 1777-1783

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Active Role of Hydrogen Bonds in Rupe and Meyer-Schuster Rearrangements.2006

    • Author(s)
      Yamabe, S.Tsuchida, N.Yamazaki, S.
    • Journal Title

      J Chem. Thorny Comput. 2

      Pages: 1379-1387

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Active Role of hydrogen Bonds in Rupe and Meyer-Schuster Rearrangements.2006

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Chem. Theory Comput. 2

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A FMO-Controlled Reaction Path in the Benzil-Benzilic Acid Rearrangement.2006

    • Author(s)
      Yamabe, S.Tsuchida, N.Yamazaki, S.
    • Journal Title

      J Org. Chem. 71

      Pages: 1777-1783

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Challenge to detect 1,4-zwitterions spectroscopically in a ketene-alkene reaction.2006

    • Author(s)
      Takahisa Machiguchi, Junko Okamoto, Yumiko Morita, Toshio Hasegawa, Shinichi Yamabe, Tsutomu Minato
    • Journal Title

      J. Am. Chem. Soc. 128

      Pages: 44-45

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A FMO-Controlled Reaction Path in the Benzil-Benzilic Acid Rearrangement2006

    • Author(s)
      Yamabe, S.
    • Journal Title

      J.Org.Chem. 71

      Pages: 1777-1783

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Quantum Chemistry Literature Data Base II Bibliography of Ab Initio Calculations for 20052006

    • Author(s)
      N. Koga, T. Matsushita, K. Takano, K. Hashimoto, M. Hada, H. Hosoya, H. Matsuzawa, U. Nagashima, H. Wasada, S. Yamabe
    • Journal Title

      J. Comp. Chem. Japan 5(5)

      Pages: 231-655

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19350014
  • [Journal Article] Symmetry or asymmetry in cheletropic additions forming cyclopropanes.2005

    • Author(s)
      S.Yamabe
    • Journal Title

      Theoret. Chem. Accounts 113

      Pages: 95-106

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Reaction Paths of the Water Assisted Neutral Hydrolysis of Ethyl Acetate2005

    • Author(s)
      S.Yamabe
    • Journal Title

      J.Phys.Chem A. 109

      Pages: 7216-7224

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Revisiting Hydrogen [1,5] Shifts in Cyclopentadiene and Cycloheptatriene as Bimolecular Reactions.2005

    • Author(s)
      Yamabe, S.Tsuchida N.Yamazaki, S.
    • Journal Title

      J. Chem. Theoiy Comput. 1

      Pages: 944-952

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Symmetry or asymmetry in cheletropic additions forming cyclopropanes.2005

    • Author(s)
      S.Yamabe
    • Journal Title

      Theoret.Chem.Accounts, 113

      Pages: 95-106

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Is the Beckmann Rearrangement a Concerted or Stepwise Reaction? A Computational Study.2005

    • Author(s)
      Yamabe, S.
    • Journal Title

      J.Org.Chem. 70

      Pages: 10638-10644

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Gas-phase ion/molecule reactions in C_5F_8.2005

    • Author(s)
      K.Hiraoka, K.Fujita, M.Ishida, T.Ichikawa, H.Okada, K.Hiizumi A.Wada, K.Takao, S.Yamabe, N.Tsuchida
    • Journal Title

      J Phys. Chem. A 109

      Pages: 1049-1056

    • NAID

      10013736942

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Reaction Paths of Tautomerization between Hydroxypyridines and Pyridones.2005

    • Author(s)
      N.Tsuchida, S.Yamabe
    • Journal Title

      J. Phys. Chem A. 109

      Pages: 1974-1980

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Tropone is a mere ketone for cycloadditions to ketenes.2005

    • Author(s)
      Junko Okamoto, Shinichi Yamabe, Tsutomu Minato, Toshio Hasegawa, Takahisa Machiguchi
    • Journal Title

      Helv Chin. Acta 88

      Pages: 1519-1539

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Revisiting Hydrogen [1,5] Shifts in Cyclopentadiene and cycloheptatriene as Bimolecular Reactions2005

    • Author(s)
      S.Yamabe
    • Journal Title

      J.Chem.Theory Comput. 1

      Pages: 944-952

    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Is the Beckmann Rearrangement a Concerted or Stepwise Reaction? A Computational Study2005

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Org. Chem. 70

      Pages: 10638-10644

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Is the Beckmann Rearrangement a Concerted or Stepwise Reaction? A Computational Study.2005

    • Author(s)
      Yamabe, S.Tsuchida, N.Yamazaki, S.
    • Journal Title

      J. Org. Chein. 70

      Pages: 10638-10644

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A mild and efficient Si(111) surface modification via hydrosilylation of activated alkynes.2005

    • Author(s)
      Liu, Y.Yamazaki, S.Yamabe, S.Nakato, Y.
    • Journal Title

      J. Mater. Chem. 15

      Pages: 4906-4913

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Thermochemical Stabilities and Structures of the Cluster Ions OCS^+, S^<2+>, H^+(OCS), and C2H5+ with OCS Molecules in the Gas Phase.2005

    • Author(s)
      K.Hiraoka, K.Fujita, M.Ishida, K.Hiizumi, F Nakagawa, A.Wada, S.Yamabe, N.Tsuchida
    • Journal Title

      Journal of the American Society for Mass Spectrometry 16

      Pages: 1760-1771

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Reaction Paths of the Water Assisted Neutral Hydrolysis of Ethyl Acetate.2005

    • Author(s)
      Shinichi Yamabe, Noriko Tsuchida, Yousuke Hayashida
    • Journal Title

      J. Phys. Chem A. 109

      Pages: 7216-7224

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Revisiting Hydrogen [1,5] Shifts in Cyclopentadiene and Cycloheptatriene as Bimolecular Reactions2005

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Chem. Theory Comput. 1

      Pages: 944-952

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Symmetry or asymmetry in cheletropic additions forming cyclopropanes.2005

    • Author(s)
      Shinichi Yamabe, Noriko Tsuchida, Tsutomu Minato, Takahisa Machiguchi
    • Journal Title

      Theoret. Chem. Accounts 113

      Pages: 95-106

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Reaction Paths of the Water Assisted Neutral Hydrolysis of Ethyl Acetate2005

    • Author(s)
      S.Yamabe
    • Journal Title

      J. Phys. Chem A. 109

      Pages: 7216-7224

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] Regioselective Hydrosilylations of Propiolate Esters with Tris(trimethylsilyl)silane.2005

    • Author(s)
      Liu, Y.Yamazaki, S.Yamabe, S.
    • Journal Title

      J Org. Chem. 70

      Pages: 556-561

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-17550103
  • [Journal Article] A Hybrid-Type Data Base: Quantum Chemistry Literature Data Base II-New Concept and New Methodology-

    • Author(s)
      K. Takano, N. Koga, T. Matsushita, K. Hashimoto, H. Hosoya, H. Matsuzawa, U. Nagashima, T. Nishikawa, H. Wasada, S. Yamabe, M. Tachikawa, M. Hada
    • Journal Title

      Bull. Chem. Soc. Japan (in press)

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19350014
  • [Presentation] A hybrid-type Data Base: Quantum Chemistry Literature Data Base II- New Concept and New Methodology-2010

    • Author(s)
      Keiko Takano, Nobuaki Koga, Toshio Matsushita, Kenro Hashimoto, Haruo Hosoya1, Hidenori Matsuzawa, Umpei Nagashima, Takeshi Nishikawa, Hiroaki Wasada, Shinichi Yamabe, Masanori Tachikawa, Masahiro Ehara, Masahiko Hada
    • Organizer
      第13回理論化学討論会
    • Place of Presentation
      北海道大学Sapporo
    • Data Source
      KAKENHI-PROJECT-19350014
  • [Presentation] The Rate-determining Step of a Favorskii Rearrangement: A Computational Study2007

    • Author(s)
      S. Yamabe
    • Organizer
      International Symposium on "Molecular Theory for Real Systems"
    • Place of Presentation
      kyoto, Japan
    • Data Source
      KAKENHI-PROJECT-19029032
  • 1.  KOGA Nobuaki (80186650)
    # of Collaborated Projects: 7 results
    # of Collaborated Products: 3 results
  • 2.  MATSUSHITA Toshio (80229468)
    # of Collaborated Projects: 5 results
    # of Collaborated Products: 3 results
  • 3.  FUJIMOTO Hiroshi (40026068)
    # of Collaborated Projects: 5 results
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  • 4.  TAKANO Keiko (00143701)
    # of Collaborated Projects: 5 results
    # of Collaborated Products: 3 results
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    # of Collaborated Projects: 5 results
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  • 6.  MACHIGUCHI Takahisa (00008864)
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    # of Collaborated Projects: 2 results
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    # of Collaborated Projects: 2 results
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  • 19.  HUZIMURA Ryoiytiro (30031537)
    # of Collaborated Projects: 2 results
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  • 20.  MATSUMURA Keiko (20031560)
    # of Collaborated Projects: 2 results
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  • 21.  YANAGISAWA Yasunori (90031591)
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    # of Collaborated Projects: 2 results
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    # of Collaborated Projects: 1 results
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    # of Collaborated Projects: 1 results
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    # of Collaborated Projects: 1 results
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    # of Collaborated Projects: 1 results
    # of Collaborated Products: 2 results
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    # of Collaborated Projects: 1 results
    # of Collaborated Products: 2 results
  • 30.  YAMASHITA Koichi (40175659)
    # of Collaborated Projects: 1 results
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    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
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    # of Collaborated Projects: 1 results
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    # of Collaborated Projects: 1 results
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    # of Collaborated Projects: 1 results
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  • 35.  SYUDO Koichi (50012612)
    # of Collaborated Projects: 1 results
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  • 36.  MATSUMURA Takeko (60031556)
    # of Collaborated Projects: 1 results
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  • 37.  WADA Yutaka (00252825)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 38.  FUJIWARA Kimiaki (80263416)
    # of Collaborated Projects: 1 results
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  • 39.  SHIGEMATSU Keiichi (40116281)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 40.  OYANAGI Wakio (00225591)
    # of Collaborated Projects: 1 results
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  • 41.  川村 尚 (40026125)
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  • 42.  市川 紘 (30061279)
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  • 43.  巽 和行 (10155096)
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  • 44.  長岡 政隆 (50201679)
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  • 45.  平尾 公彦 (70093169)
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  • 46.  北浦 和夫 (30132723)
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