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2016 Fiscal Year Research-status Report

3D活性サイト科学の海外拠点・国際ネットワーク構築

International Activities Supporting Group

Project Area3D Active-Site Science
Project/Area Number 15K21719
Research InstitutionNara Institute of Science and Technology

Principal Investigator

大門 寛  奈良先端科学技術大学院大学, 物質創成科学研究科, 教授 (20126121)

Co-Investigator(Kenkyū-buntansha) 佐々木 裕次  東京大学, 大学院新領域創成科学研究科, 教授 (30344401)
野村 琴広  首都大学東京, 理工学研究科, 教授 (20304165)
林 好一  名古屋工業大学, 工学(系)研究科(研究院), 教授 (20283632)
木下 豊彦  公益財団法人高輝度光科学研究センター, 利用研究促進部門, 主席研究員 (60202040)
若林 裕助  大阪大学, 基礎工学研究科, 准教授 (40334205)
細川 伸也  熊本大学, 大学院先端科学研究部(理), 教授 (30183601)
松井 文彦  奈良先端科学技術大学院大学, 物質創成科学研究科, 准教授 (60324977)
筒井 一生  東京工業大学, 科学技術創成研究院, 教授 (60188589)
福村 知昭  東北大学, 原子分子材料科学高等研究機構, 教授 (90333880)
森川 良忠  大阪大学, 工学研究科, 教授 (80358184)
小林 伸彦  筑波大学, 数理物質系, 准教授 (10311341)
郷原 一寿  北海道大学, 工学研究院, 教授 (40153746)
山田 容子  奈良先端科学技術大学院大学, 物質創成科学研究科, 教授 (20372724)
松下 智裕  公益財団法人高輝度光科学研究センター, 制御・情報部門, 部門長 (10373523)
鷹野 優  広島市立大学, 情報科学研究科, 教授 (30403017)
Project Period (FY) 2015-11-06 – 2019-03-31
Keywords活性サイト / 不純物 / 先端材料 / 光電子ホログラフィー / 蛍光X線ホログラフィー / 表面界面ホログラフィー / 電子回折イメージング / 第一原理計算
Outline of Annual Research Achievements

国際支援活動班の目標は新学術領域研究3D活性サイト科学を基盤とした強い日本の科学技術を世界に広めることである。まず、ホログラムデータ形式の標準化や解析コードの配布を目指したデータベース構築を始めた。そのために有力な海外研究者を本新学術領域研究活動に参画させ、本領域の概念と意義について深く理解するユーザー開拓を行っている。本年は英語版のマニュアル作成も行った。また、国際活動支援体制の基盤造りとして、欧州の放射光実験施設内に拠点の設置を進めている。中型放射光施設MAX IV(Sweden)のユーザーミーティングに参加し、施設責任者と拠点活動についての協議を行った。松下・松井・大門らが開発している小型・高性能分析器をMAX IV/SLSの軟X線beam lineに設置することを前提に、実際に現地で共同製作するなど技術供与・共同研究の具体案を協議した。並行してESRF(仏)とSLS(Swiss)にて共同実験を行った。さらに蛍光X線holographyについては高速蛍光X線検出装置を新たに現地で製作して、ESRFのゴニオメータに組み込む。装置の重要部品である湾曲グラファイトは国内で作製した。他の部分は林・細川が主導して現地で共同開発する。第一原理order N法コードConquestへの有限温度分子動力学法と、反応自由energy障壁計算手法の組み込みにボルドー大グループと共同研究を進めている。不均一触媒反応に適用し、大規模simulationによるナノ触媒の特異な反応性を発現する「反応の活性サイト」の構造と電子状態を調べ、反応性を支配する要因について明らかにすることを目指し、森川が現地で基盤づくりのための打合せを行った。蛍光X線holography測定の検出器として新たに候補となるエネルギー分解型光子数計数2次元検出器の適用について、共同研究及び試用実について協議を進めている。

Current Status of Research Progress
Current Status of Research Progress

2: Research has progressed on the whole more than it was originally planned.

Reason

本領域メンバーは個人レベルで国外放射光施設での実験が日常化しており、また領域メンバーを海外で継続的に活動できる海外研究拠点についても、申請準備段階から協議を続けてきた。本年も引き続き、スイス放射光施設ESRFにてビームタイムを獲得し、共同実験を実施し、並行して当新学術領域の活動にて開発してきた分析器・解析ソフトの普及について議論する機会を確保できた。

Strategy for Future Research Activity

平成28年度に引き続き、2次元光電子検出装置と高速蛍光X線検出装置の開発を欧州の海外放射光施設において進める。また、それらを用いて原子分解能ホログラムの測定を行う。国内から、特に若手研究者を派遣し実験を行う。測定法について英語版のマニュアルを整備した。海外からのフィードバックを参考に推敲していく。
Neel研究所を拠点に、欧州内の優れた試料を収集するが、より先端の計測を要する場合には、装備の整っている国内施設での実験が望ましい。この場合16年度以降のbeam timeを海外研究者のために、成果公開優先課題等の制度を利用して確保し実験を行う。一方、LIGA process発祥の地である独Karlsruher工科大学グループと、表面・界面holographyに最適化したX線集光素子の共同開発を行う。また、有機物質については、Marburg大を拠点とした探索を行う。
初年度に引き続き、London大及びBordeaux大と共同で大規模simulation codeの開発を行う。Conquestコードに自由energy計算手法を組み込み、数万から数十万原子を含む不均一触媒反応のsimulationを可能にすることによって、不均一触媒の活性サイトの構造と電子状態、cluster sizeと反応性の関連性について、活性サイトの原子配列の結果と併せることによって機構を解明する。国際共同研究の拠点となるMAX IVと共同で2017年度に3D活性サイト科学の研究交流workshopを計画している。
これらの計画を実行することにより多くの成果が得られる。関わった研究者らを一堂に集め議論する機会が、communityを形成する上で重要である。そのための準備として海外研究協力者や国際advisorとの打ち合わせを行う。

Causes of Carryover

.

Expenditure Plan for Carryover Budget

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  • Research Products

    (196 results)

All 2017 2016 Other

All Int'l Joint Research (6 results) Journal Article (122 results) (of which Int'l Joint Research: 25 results,  Peer Reviewed: 118 results,  Open Access: 95 results,  Acknowledgement Compliant: 119 results) Presentation (61 results) (of which Int'l Joint Research: 57 results,  Invited: 58 results) Book (2 results) Remarks (3 results) Funded Workshop (2 results)

  • [Int'l Joint Research] カールスエー工科大学(Germany)

    • Country Name
      Germany
    • Counterpart Institution
      カールスエー工科大学
  • [Int'l Joint Research] MAX IV(Sweden)

    • Country Name
      Sweden
    • Counterpart Institution
      MAX IV
  • [Int'l Joint Research] 欧州シンクトロン放射光研究所(France)

    • Country Name
      France
    • Counterpart Institution
      欧州シンクトロン放射光研究所
  • [Int'l Joint Research] Swiss Light Source/Vacuum Ultraviolet and X-ray Physics(スイス)

    • Country Name
      SWITZERLAND
    • Counterpart Institution
      Swiss Light Source/Vacuum Ultraviolet and X-ray Physics
  • [Int'l Joint Research] デプレチェン大学(Hungary)

    • Country Name
      Hungary
    • Counterpart Institution
      デプレチェン大学
  • [Int'l Joint Research]

    • # of Other Countries
      2
  • [Journal Article] Characterization of local hydrophobicity on sapphire (0001) surfaces in aqueous environment by colloidal probe atomic force microscopy2017

    • Author(s)
      Wada Tomoya、Yamazaki Kenji、Isono Toshinari、Ogino Toshio
    • Journal Title

      Appl. Surf. Sci

      Volume: 396 Pages: 1206~1211

    • DOI

      10.1016/j.apsusc.2016.11.112

    • Peer Reviewed
  • [Journal Article] (10)Protein crystallography beamline BL2S1 at the Aichi synchrotron,2017

    • Author(s)
      N. Watanabe, T. Nagae, Y. Yamada, A. Tomita, N. Matsugaki, M. Tabuchi;
    • Journal Title

      J. Synchrotron Rad.

      Volume: 24 Pages: 338-343

    • DOI

      https://doi.org/10.1107/S1600577516018579

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] (4)Microstructural observation of Fuel cell catalyst inks by Cryo-SEM and Cryo-TEM2017

    • Author(s)
      Ito, Yuri Nishino and Atsuo Miyazawa
    • Journal Title

      Microscopy, 2017 in press

      Volume: - Pages: -

    • DOI

      doi: 10.1093/jmicro/dfx001

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] (3)Observation of ionomer in catalyst ink of polymer electrolyte fuel cell using cryogenic transmission electron microscopy2017

    • Author(s)
      Shinichi Takahashi, Junichi Shimanuki, Tetsuya Mashio, Atsushi Ohma, Hajime Tohma, Ayumi Ishihara, Yoshiko Ito, Yuri Nishino and Atsuo Miyazawa,
    • Journal Title

      Electrochimica Acta, 2017 in press

      Volume: - Pages: -

    • DOI

      DOI: 10.1016/j.electacta.2016.12.068

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] "High-Mobility and Low-Carrier-Density Sputtered-MoS2 Film by Introducing Residual Sulfur during Low-Temperature in 3%-H2 Annealing for 3D-ICs2017

    • Author(s)
      Jun’ichi Shimizu, Takumi Ohashi, Kentaro Matsuura, Iriya Muneta, Kuniyuki Kakushima, Kazuo Tsutsui and Hitoshi Wakabayashi
    • Journal Title

      Japanese Journal of Applied Physics:accepted and to be published

      Volume: - Pages: -

    • DOI

      DOI: 10.1021/nl303583v

    • Open Access / Acknowledgement Compliant
  • [Journal Article] Forced unfolding mechanism of bacteriorhodopsin as revealed by coarse-grained molecular dynamics2017

    • Author(s)
      T. Yamada, T. Yamato, S. Mitaku
    • Journal Title

      Biophys. J.

      Volume: - Pages: -

    • DOI

      DOI: 10.1016/j.bpj.2016.09.051

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Structurally conserved channels in cyanobacterial and plant photosystem II.2017

    • Author(s)
      N. Sakashita, H. C. Watanabe, T. Ikeda, *H. Ishikita
    • Journal Title

      Photosynth, Res. in press.

      Volume: - Pages: -

    • DOI

      DOI: 10.1007/s11120-017-0347-1

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] A single amino acid mutation converts (R)-5-diphosphomevalonate decarboxylase into a kinase2017

    • Author(s)
      K. Motoyama, H. Unno, A. Hattori, T. Takaoka, H. Ishikita, H. Kawaide, T. Yoshimura, *H. Hemmi
    • Journal Title

      J. Biol. Chem. in press.

      Volume: - Pages: -

    • DOI

      doi: 10.1074/jbc.M116.752535

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Common folding processes of the fast-folding proteins: Partial formations of secondary structures initiate the immediate protein folding2017

    • Author(s)
      *R. Harada,*Y. Takano, *Y. Shigeta,
    • Journal Title

      J. Comput. Chem. in press.

      Volume: - Pages: -

    • DOI

      DOI: 10.1002/jcc.24748

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Comparative Study of Single and Dual Gain-Narrowed Emission in 2 Thiophene/Furan/Phenylene Co-Oligomer Single Crystals2017

    • Author(s)
      H. Shang, H. Shimotani, S. Ikeda, T. Kanagasekaran, K. Oniwa, T. Jin, N. Asao, Y. Yamamoto, *H. Tamura, K. Abe, M. Kanno, M. Yoshizawa, and K. Tanigaki
    • Journal Title

      J Phys. Chem. C,

      Volume: 121 Pages: 2364-2368

    • DOI

      DOI: 10.1021/acs.jpcc.6b10827

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Charge transport calculations by a wave-packet dynamical approach using maximally localized Wannier functions based on density functional theory:Application to high-mobility organic semiconductors2017

    • Author(s)
      H. Ishii, N. Kobayashi, K. Hirose
    • Journal Title

      Phys. Rev. B

      Volume: 95 Pages: 035433-1-7

    • DOI

      DOI:https://doi.org/10.1103/PhysRevB.95.035433

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Determination of geometric and electronic structures of organic crystals from first principles: Role of the molecular configuration on the electronic structure,2017

    • Author(s)
      S. Yanagisawa nd I. Hamada,
    • Journal Title

      J. Appl. Phys.

      Volume: 121 Pages: 045501-1-10

    • DOI

      doi: http://dx.doi.org/10.1063/1.4974844

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Machine Learning for Atomic Forces in a Crystalline Solid: Transferability to Various Temperatures2017

    • Author(s)
      T. Suzuki, R. Tamura, T. Miyazaki
    • Journal Title

      Int. J. Quantum Chem.

      Volume: 117 Pages: 33-39

    • DOI

      DOI:10.1002/qua.25307

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Emergence of the Dirac Electron System in a Single-Component Molecular Conductor under High Pressure2017

    • Author(s)
      Reizo Kato, HengBo Cui, Takao Tsumuraya, Tsuyoshi Miyazaki, and Yoshikazu Suzumura
    • Journal Title

      J. Am. Chem. Soc.,

      Volume: 139 Pages: 1770-1773

    • DOI

      http://pubs.acs.org/doi/abs/10.1021/jacs.6b12187

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] First-principles calculation method and its applications for two-dimensional materials2017

    • Author(s)
      Y. Egami, S. Tsukamoto, T. Ono
    • Journal Title

      Quantum Matter, accepted.

      Volume: - Pages: -

    • Peer Reviewed
  • [Journal Article] Self-energy operator matrix for electron transport calculations within real-space finite-difference formalism2017

    • Author(s)
      S. Tsukamoto, T. Ono, K. Hirose, S. Blugel
    • Journal Title

      Phys. Rev. E, accepted.

      Volume: - Pages: -

    • DOI

      https://doi.org/10.1103/PhysRevE.95.033309

    • Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] S. Tsukamoto, T. Ono, K. Hirose, S. Blugel2017

    • Author(s)
      S. Tsukamoto, T. Ono, K. Hirose, S. Blugel
    • Journal Title

      Phys. Rev. E, accepted.

      Volume: - Pages: -

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] First-Principles Molecular Dynamics Analysis of Ligand-Free Suzuki-Miyaura Cross Coupling in Water Solvent: Oxidative Addition Step2017

    • Author(s)
      T. Hirakawa, Y. Uramoto, D. Mimura, A. Takeda, S. Yanagisawa, T. Ikeda, K. Inagaki, and Y. Morikawa
    • Journal Title

      J. Phys. Chem. B,

      Volume: 121 Pages: 164-173

    • DOI

      DOI: 10.1021/acs.jpcb.6b08644

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Intrinsic origin of electron scattering at the 4H-SiC(0001)/SiO2 interface2017

    • Author(s)
      S. Iwase, C. J. Kirkham, T. Ono
    • Journal Title

      Phys. Rev. B,

      Volume: 95 Pages: 041302

    • DOI

      DOI:https://doi.org/10.1103/PhysRevB.95.041302

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] A Support Construction for CT Image Based on K-Means Clustering2017

    • Author(s)
      W. Dhammatorn and H. Shioya
    • Journal Title

      Journal of Computer and Communications,

      Volume: 5 Pages: 137-151

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Atomic and local electronic structures of Ca2AlMnO5+δ as an oxygen storage material2017

    • Author(s)
      G. Saito, Y. Kunisada, K. Hayami, T. Nomura, N. Sakaguchi
    • Journal Title

      Chemistry of Materials,

      Volume: 29 Pages: 648-655

    • DOI

      DOI: 10.1021/acs.chemmater.6b04099

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Applicability of Density Functional Tight Binding Method with Dispersion Correction to Investigate the Adsorption of Porphyrin/Porphycene Metal Complexes on Graphene2017

    • Author(s)
      Y. Kanematsu, K. Gohara, H. Yamada, and Y. Takano
    • Journal Title

      Chemistry letters

      Volume: 46 Pages: 51-52

    • DOI

      DOI: http://dx.doi.org/10.1246/cl.160887

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] In-Plane Positional Fluctuations of Zinc Atoms in Single Crystal Mg85Zn6Y9 Alloy Studied by X-ray Fluorescence Holography2017

    • Author(s)
      K. Kimura, K. Hayashi, K. Hagihara, H. Izuno, N. Happo, S. Hosokawa, M. Suzuki, H. Tajiri
    • Journal Title

      Materials Transactions in press

      Volume: - Pages: -

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Time-resolved soft X-ray core-level photoemission spectroscopy at 880 °C using the pulsed laser and synchrotron radiation and the pulse heating current2017

    • Author(s)
      T. Abukawa, S. Yamamoto, R. Yukawa, S. Kanzaki, K. Mukojima, I. Matsuda
    • Journal Title

      Surf. Sci.

      Volume: 656 Pages: 43-47

    • DOI

      http://doi.org/10.1016/j.susc.2016.09.006

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Development of optical choppers for time-resolved measurements in soft-X-ray beamlines of synchrotron radiation facilities2017

    • Author(s)
      Hitoshi Osawa, Takuo Ohkochi, Masami Fujisawa, Shigeru Kimura, Toyohiko Kinoshita
    • Journal Title

      J. Synchrotron Rad. (accepted)

      Volume: - Pages: -

    • DOI

      https://doi.org/10.1107/S1600577517002399

    • Open Access / Acknowledgement Compliant
  • [Journal Article] Surface science at the PEARL beamline of the Swiss Light2017

    • Author(s)
      "Matthias Muntwiler, Jun Zhang, Roland Stania, Fumihiko Matsui, Peter Oberta, Uwe Flechsig, Luc Patthey, Christoph Quitmann, Thilo Glatzel, Roland Widmer, Ernst Meyer, Thomas A. Jung, Philipp Aebi, Roman Fasel and Thomas Greber"
    • Journal Title

      J. Synchrotron Rad.

      Volume: 24 Pages: 354-366

    • DOI

      https://doi.org/10.1107/S1600577516018646

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Phonon excitations in Pd40Ni40P20 bulk metallic glass by inelastic x-ray scattering2017

    • Author(s)
      S. Hosokawa, M. Inui, Y. Kajihara, T. Ichitsubo, K. Matsuda, H. Kato, A. Chiba, K. Kimura, K. Kamimura, S. Tsutsui, H. Uchiyama, A. Q. R. Baron
    • Journal Title

      Materials Science Forum

      Volume: 879 Pages: 767-772

    • DOI

      10.4028/www.scientific.net/MSF.879.767

    • Peer Reviewed / Open Access
  • [Journal Article] Impurity effects in the microscopic elastic properties of polycrystalline Mg-Zn-Y alloys with a synchronized long-period stacking ordered phase2017

    • Author(s)
      S. Hosokawa, K. Kimura, M. Yamasaki, Y. Kawamura, K. Yoshida, M. Inui, S. Tsutsui, A.Q.R. Baron, Y. Kawakita, S. Itoh
    • Journal Title

      Journal of Aolloys and Compounds

      Volume: 695 Pages: 426-432

    • DOI

      http://doi.org/10.1016/j.jallcom.2016.10.266

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] "Upper critical field reaches 90 tesla near the Mott transition in fulleride superconductors"2017

    • Author(s)
      Y. Kasahara, Y. Takeuchi, R.H. Zadik, Y. Takabayashi, R.H. Colman, R.D. McDonald, M.J.Rosseinsky, K. Prassides, Y. Iwasa
    • Journal Title

      Nature Communications, to be published

      Volume: - Pages: -

    • DOI

      doi:10.1038/ncomms14467

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Engineering Thin Films of a Tetrabenzoporphyrin toward Efficient Charge-Carrier Transport: Selective Formation of a Brickwork Motif2017

    • Author(s)
      K. Takahashi, B. Shan, X. Xu, S. Yang, T. Koganezawa, D. Kuzuhara, N. Aratani, M. Suzuki,* Q. Miao,* H. Yamada*
    • Journal Title

      ACS Appl. Mater. Interfaces,

      Volume: - Pages: -

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] “Metal-Support Cooperative Catalysts for Environmentally Benign Molecular Transformations”2017

    • Author(s)
      K. Kaneda, T. Mitsudome
    • Journal Title

      Chem. Rec.,

      Volume: 17 Pages: 4-26

    • DOI

      DOI: 10.1002/tcr.201600036

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Synthesis of mono, di, and trinuclear rhodium diphosphine complexes containing light-harvesting fluorene backbones”2017

    • Author(s)
      Y. Matsusaka, S. Shitaya, K. Nomura, A. Inagaki
    • Journal Title

      Inorg. Chem. (Communication),

      Volume: 56 Pages: 1027-1030

    • DOI

      DOI: 10.1021/acs.inorgchem.6b02423

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Synthesis of vanadium-alkylidene complexes and their use and catalysts for ring opening metathesis polymerization”2017

    • Author(s)
      K. Nomura, X. Hou
    • Journal Title

      Dalton Trans, 46, 12-24 (2017). Perspective

      Volume: 46 Pages: 12-24

    • DOI

      DOI: 10.1039/C7DT90001E

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] “Development of Multi-Active Site Catalysts for Surface Concerted Catalysis Aimed at One-Pot Synthesis”,2017

    • Author(s)
      K. Motokura*
    • Journal Title

      Bull. Chem. Soc. Jpn.,

      Volume: 90 Pages: 137-147

    • DOI

      10.1246/bcsj.20160291

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] E-Selective Dimerization of Phenylacetylene Catalyzed by Cationic Tris(mu-hydroxo)diruthenium(II) Complex and the Mechanistic Insight: The Role of Two Ruthenium Centers in Catalysis2017

    • Author(s)
      S. Kiyota, H. Soeta, N.Komine, S. Komiya, *M.Hirano
    • Journal Title

      J. Mol. Cata., A: Chemical,

      Volume: 426 Pages: 4190428

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Structural and ferromagnetic properties of InMnAs thin films including MnAs nanoclusters grown on InP substrates2017

    • Author(s)
      H. Yoshizawa, *H. Toyota, S. Nakamura, M. Yamazaki, *N. Uchitomi
    • Journal Title

      Thin Solid Films

      Volume: 622 Pages: 136-141

    • DOI

      http://doi.org/10.1016/j.tsf.2016.12.020

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Microstructure analysis of IrO2 thin films2017

    • Author(s)
      *X. Hou, R. Takahashi, T. Yamamoto, M. Lippmaa
    • Journal Title

      J. Cryst. Growth

      Volume: 462 Pages: 24-28

    • DOI

      http://doi.org/10.1016/j.jcrysgro.2016.12.104

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Magnetic and magnetodielectric properties of epitaxial iron vanadate thin films2017

    • Author(s)
      D. Zhou, R. Takahashi, Y. Zhou, D. Kim, V. K. Suresh, Y.-H. Chu, Q. He, P. Munroe, M. Lippmaa, J. Seidel, *N. Valanoor
    • Journal Title

      Adv. Electron. Mater.

      Volume: 3 Pages: 1600295

    • DOI

      DOI: 10.1002/aelm.201600295

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] (12)Characterization of group II chaperonins from an acidothermophilic archaeon Picrophilus torridus,2016

    • Author(s)
      Y.Y. Yamamoto, K. Tsuchida, K. Noguchi, N. Ogawa, H. Sekiguchi, Y. C. Sasaki, M. Yohda;
    • Journal Title

      FEBS OPEN BIO,

      Volume: 6 Pages: 751-764

    • DOI

      doi: 10.1002/2211-5463.12090

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Development of an X-ray fluorescence holographic measurement system for protein crystals2016

    • Author(s)
      A. Sato-Tomita, N. Shibayama, N. Happo, K. Kimura, T. Okabe, T. Matsushita, S.-Y. Park, Y. C. Sasaki, K. Hayashi,
    • Journal Title

      Rev. Sci. Inst.

      Volume: 87 Pages: 063707

    • DOI

      http://dx.doi.org/10.1063/1.4953453

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] (9)Structural insight into photoactivation of an adenylate cyclase from a photosynthetic cyanobacterium2016

    • Author(s)
      Ohki M, Sugiyama K, Kawai F, Tanaka H, Nihei Y, Unzai S, Takebe M, Matsunaga S, Adachi S, Shibayama N, Zhou Z, Koyama R, Ikegaya Y, Takahashi T, Tame J, Iseki M, Park S-Y..
    • Journal Title

      Proc Natl Acad Sci USA

      Volume: - Pages: 6659-6664

    • DOI

      doi: 10.1073/pnas.1517520113

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] (8)Structural dynamics of a single-chain Fv antibody against (4-hydroxy-3-nitrophenyl)acetyl,2016

    • Author(s)
      Y. Sato, Y. Tanaka, S. Inaba, H. Sekiguchi, T. Maruno, Y. C. Sasaki, H. Fukada, Y. Kobayashi, T. Azuma, M. Oda,
    • Journal Title

      International Journal of Biological Macromolecules,

      Volume: 91 Pages: 151-157

    • DOI

      http://doi.org/10.1016/j.ijbiomac.2016.05.074

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] (7)A small-angle X-ray scattering study of alpha-synuclein from human red blood cells,2016

    • Author(s)
      K. Araki, N. Yagi, R. Nakatani, H. Sekiguchi, M. So, H. Yagi, N. Ohta, Y. Nagai, Y. Goto and H. Mochizuki,
    • Journal Title

      Scientific Reports

      Volume: 6 Pages: 30473

    • DOI

      doi:10.1038/srep30473

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] (6)Direct Correlation between Molecular Cross-linking and Macroscopic Mechanical Properties for Green Solids of Deoxyribonucleic Acids2016

    • Author(s)
      Y. Morimitsu, H. Matsuno, N. Ohta, H. Sekiguchi, K. Tanaka,
    • Journal Title

      ChemNanoMat

      Volume: 2 Pages: 1023

    • DOI

      DOI: 10.1021/bm1010933

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Time-resolved observation of structural change of copper induced by laser shock using synchrotron radiation with dispersive XAFS"2016

    • Author(s)
      Y. Niwa, T. Sato, K. Ichiyanagi, K. Takahashi, and M. Kimura,
    • Journal Title

      High Pressure, Research

      Volume: 36 Pages: 471

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Peptidome and transcriptome analysis of the toxin-like peptides in the venom glands of tarantula Grammostola rosea.”2016

    • Author(s)
      Kimura, T. & Kubo, T.,
    • Journal Title

      Spider Venoms, pp 251-270, Eds. P. Gopalakrishnakone, et al., Springer,

      Volume: - Pages: 251-270

    • DOI

      DOI:10.1007/978-94-007-6646-4_13-1 (2016)

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] A high performance platform based on cDNA display for efficient synthesis of protein fusions and accelerated directed evolution.2016

    • Author(s)
      Naimuddin, M., & Kubo, T.
    • Journal Title

      ACC Combinatorial Science,

      Volume: 18 Pages: 117-129

    • DOI

      DOI: 10.1021/acscombsci.5b00139

    • Open Access / Acknowledgement Compliant
  • [Journal Article] Unusual energy separation of subbands in Si(111) p-channels induced by In adsorption.2016

    • Author(s)
      Nur Idayu Ayob, Sakura N. Takeda*, Tomohiro Sakata, Masaaki Yoshikawa, Makoto Morita, Hiroshi Daimon
    • Journal Title

      Japanese Journal of Applied Physics:

      Volume: 54 Pages: 065702

    • DOI

      DOI:10.7567/JJAP.54.065702

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Atomic Image Reconstruction from Atomic Resolution Holography Using L1-Regularized Linear Regression2016

    • Author(s)
      T. Matsushita
    • Journal Title

      e-J. Surf. Sci. Nanotech.

      Volume: 14 Pages: -

    • DOI

      http://doi.org/10.1380/ejssnt.2016.158

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Reparameterization of PM6 applied to organic diradical molecules2016

    • Author(s)
      *T. Saito, Y. Kitagawa, Y. Takano
    • Journal Title

      J. Phys. Chem. A,

      Volume: 120 Pages: 8750-8760

    • DOI

      DOI: 10.1021/acs.jpca.6b08530

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  • [Journal Article] Inverse Ubbelohde effect in the short hydrogen bond of photosystem II: Relation between H/D isotope effect and symmetry in potential energy profile2016

    • Author(s)
      *Y. Kanematsu, M. Tachikawa, *Y. Takano
    • Journal Title

      J. Comput. Chem.

      Volume: 37 Pages: 2140-2145

    • DOI

      DOI: 10.1002/jcc.24438

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] pKa of a proton conducting water chain in photosystem II2016

    • Author(s)
      T. Takaoka, N. Sakashita, K. Saito, *H. Ishikita,
    • Journal Title

      J. Phys. Chem. Lett.

      Volume: 7 Pages: 1925-1932

    • DOI

      DOI: 10.1021/acs.jpclett.6b00656

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] A method for predicting protein conformational pathways by using molecular dynamics simulations guided by difference distance matrices,2016

    • Author(s)
      *Y. Yonezawa,
    • Journal Title

      J. Comput. Chem.,

      Volume: 37 Pages: 1139-1146

    • DOI

      DOI: 10.1002/jcc.24296

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] TaBoo SeArch (TBSA) algorithm with a modified inverse histogram for reproducing biologically relevant rare-events of proteins,2016

    • Author(s)
      *R. Harada,*Y. Takano, *Y. Shigeta,
    • Journal Title

      J. Chem. Theory Comput.,

      Volume: 12 Pages: 2436-2445

    • DOI

      DOI: 10.1021/acs.jctc.6b00082

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Molecular packing determines charge separation in a liquid crystalline bisthiophene&8722;perylene diimide donor&8722;acceptor material2016

    • Author(s)
      Matthias Polkehn, Hiroyuki Tamura, Pierre Eisenbrandt, Stefan Haacke, Stephane Mery, and Irene Burghardt
    • Journal Title

      J. Phys. Chem. Lett.

      Volume: 7 Pages: 1327-1334

    • DOI

      doi: 10.1021/acs.jpclett.6b00277

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Diabatization for time-dependent density functional theory: Exciton transfers and related conical intersections2016

    • Author(s)
      *H. Tamura
    • Journal Title

      J Phys. Chem. A,

      Volume: 120 Pages: 9341-9347

    • DOI

      DOI: 10.1021/acs.jpca.6b09854

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Two different ground states in K-intercalated polyacenes2016

    • Author(s)
      Q. T. N. Phan, S. Heguri, *H. Tamura, T. Nakano, Y. Nozue, and K. Tanigaki,
    • Journal Title

      Phys. Rev. B

      Volume: 93 Pages: 075130-1-6

    • DOI

      DOI:https://doi.org/10.1103/PhysRevB.93.075130

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Control of optical and electrical properties of nanosheets by the chemical structure of the turning point in a foldable polymer2016

    • Author(s)
      T. Ikeda, *H. Tamura, T. Sakurai, and S. Seki,
    • Journal Title

      Nanoscale

      Volume: 8 Pages: 14673-14681

    • DOI

      DOI: 10.1039/C6NR01066K

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Dynamics of the triplet pair state reveals the likely co-existence of coherent and incoherent singlet fission in crystalline hexacene2016

    • Author(s)
      N. R. Monahan, D. Su, *H. Tamura, K. W. Williams, B. Xu, Y. Zhong, B. Kumar, C. Nuckolls, A. R. Harutyunyan, G. Chen, H.-L. Dai, D. Beljonne, Y. Rao, X.-Y. Zhu,
    • Journal Title

      Nature Chemistry, in press.

      Volume: - Pages: -

    • DOI

      doi:10.1038/nchem.2665

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Suppressing molecular vibrations in organic semiconductors by inducing strain,2016

    • Author(s)
      T. Kubo, R. Ha¨usermann, J. Tsurumi, J. Soeda, Y. Okada, Y. Yamashita, N. Akamatsu, *A. Shishido, C. Mitsui, T. Okamoto, S. Yanagisawa, *H. Matsui and *J. Takeya,
    • Journal Title

      Nature Communications,

      Volume: 7 Pages: 11156

    • DOI

      doi:10.1038/ncomms11156

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Linear-scaling first-principles molecular dynamics of complex biological systems with the Conquest code2016

    • Author(s)
      Takao Otsuka, M. Taiji, D. Bowler, T. Miyazaki
    • Journal Title

      Jpn. J. Appl. Phys

      Volume: 55 Pages: 1102B1-1

    • DOI

      DOI:10.7567/JJAP.55.1102B1

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] First-principles study on oxidation of Ge and its interface electronic structures2016

    • Author(s)
      T. Ono, S. Saito, S. Iwase
    • Journal Title

      Jpn. J. Appl. Phys

      Volume: 55 Pages: 08PA01

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Self-consistent van der Waals density functional study of benzene adsorption on Si(100)2016

    • Author(s)
      Y. Hamamoto, I. Hamada, K. Inagaki, and Y. Morikawa
    • Journal Title

      Phys. Rev. B,

      Volume: 93 Pages: 245440

    • DOI

      https://doi.org/10.1103/PhysRevB.93.245440

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Density Functional Theory Investigationsj of Ferrocene-Terminated Self-Assembled Monolayers: Electronic State Changes Induced by Electric Dipole Field of Coadsorbed Species2016

    • Author(s)
      Y. Yokota, S. Akiyama, Y. Kaneda, A. Imanishi, K. Inagaki, Y. Morikawa, and K. Fukui
    • Journal Title

      J. Phys. Chem. C,

      Volume: 120 Pages: 8684-8692

    • DOI

      DOI: 10.1021/acs.jpcc.6b00812

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Ab-initio moleculer dynamics of solvation effects on reactiveity at electrified interfaces2016

    • Author(s)
      J.A. Herron, *Y. Morikawa, and *M. Mavrikakis
    • Journal Title

      Proc. Natl. Acad. Sci. U. S. A.,

      Volume: 113 Pages: E4937-4945

    • DOI

      doi: 10.1073/pnas.1604590113

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Characteristics of Lithium Ions and Superoxide Anions in EMI-TFSI and Dimethyl Sulfoxide2016

    • Author(s)
      S. Jung, F. F. Canova and K. Akagi
    • Journal Title

      J. Phys. Chem. A

      Volume: 120 Pages: 364-371

    • DOI

      DOI: 10.1021/acs.jpca.5b09692

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] First-Principles Study on Electron Conduction at 4H-SiC(0001)/SiO2 Interface2016

    • Author(s)
      C. J. Kirkham, T. Ono
    • Journal Title

      Mater. Sci. Forum

      Volume: 858 Pages: 457-460

    • DOI

      doi: 10.1149/07505.0121ecst

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Importance of SiC Stacking to Interlayer States at the SiC/SiO2 Interface2016

    • Author(s)
      T. Ono, C. J. Kirkham, S. Iwase
    • Journal Title

      ECS Transactions,

      Volume: 75 Pages: 121-126

    • DOI

      DOI 10.4028/www.scientific.net/MSF.858.457

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Measurement of the dielectric function of α-Al2O3 by transmission electron microscopy - electron energy-loss spectroscopy without Cerenkov radiation effects2016

    • Author(s)
      N. Sakaguchi, L. Tanda, Y. Kunisada
    • Journal Title

      Ultramicroscopy,

      Volume: 169 Pages: 37-43

    • DOI

      doi: 10.1016/j.ultramic.2016.07.003

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Carbon nanohorns allow acceleration of osteoblast differentiation via macrophages activation2016

    • Author(s)
      E. Hirata, E. Miyako, N. Hanagata, N. Ushijima, N. Sakaguchi, J. Russier, M. Yudasaka, S. Iijima, A. Bianco, A. Yokoyama
    • Journal Title

      Nanoscale,

      Volume: 8 Pages: 14514-14522

    • DOI

      DOI: 10.1039/c6nr02756c

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Gas Nanobubbles as Nucleation Acceleration in the Gas-Hydrate Memory Effect2016

    • Author(s)
      T. Uchida, K. Yamazaki, and K. Gohara: Gas Nanobubbles as Nucleation Acceleration in the Gas-Hydrate Memory Effect, J. Phys. Chem. C,120(47),26620-26629, 2016.
    • Journal Title

      J. Phys. Chem. C

      Volume: 120 Pages: 26620-26629

    • DOI

      DOI: 10.1021/acs.jpcc.6b07995

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] A divalent rare earth oxide semiconductor: yttrium monoxide2016

    • Author(s)
      K. Kaminaga, R. Sei, K. Hayashi, N. Happo, H. Tajiri, D. Oka, T. Fukumura, T. Hasegawa
    • Journal Title

      Appl. Phys. Lett. 1

      Volume: 108 Pages: 122102

    • DOI

      doi: http://dx.doi.org/10.1063/1.4944330

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Structural Change of the Rutile-TiO2(110) Surface During the Photoinduced Wettability Conversion2016

    • Author(s)
      T. Shirasawa, W. Voegeli, E. Arakawa, T. Takahashi, and T. Matsushita
    • Journal Title

      J. Phys. Chem. C

      Volume: 120 Pages: 29107-29115

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      DOI: 10.1021/jp002525j

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Interfacially engineered oxygen octahedral rotations and their impact on strain relief in coherently grown SrRuO3 films2016

    • Author(s)
      D. Kan, Y. Wakabayashi, H. Tajiri, and Y. Shimakawa
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      Phys. Rev. B

      Volume: 94 Pages: 024112-1-6

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  • [Journal Article] Chemical and orbital fluctuations in Ba3CuSb2O92016

    • Author(s)
      Y. Wakabayashi, D. Nakajima, Y. Ishiguro, K. Kimura, T. Kimura, S. Tsutsui, A. Q. R. Baron, K. Hayashi, N. Happo, S. Hosokawa, K. Ohwada, and S. Nakatsuji
    • Journal Title

      Phys. Rev. B

      Volume: 93 Pages: 245117-1-13

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  • [Journal Article] "Interband interaction between bulk and surface resonance bands of a Pb-adsorbed Ge(001) surface "2016

    • Author(s)
      Tomohiro Sakata, Sakura N Takeda, Kosuke Kitagawa and Hiroshi Daimon
    • Journal Title

      Semiconductor Science and Technology, Vol. 31, No. 8, 085012 (2016)

      Volume: 31 Pages: 085012

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Bi induced superstructures on Si(110)2016

    • Author(s)
      Artoni Kevin R. Ang, Sakura Nishino Takeda, Hiroshi Daimon
    • Journal Title

      J. Vac. Sci. Technol. A

      Volume: 34 Pages: 051401

    • DOI

      doi: http://dx.doi.org/10.1116/1.4958803

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Interfacial atomic site characterization by photoelectron diffraction for 4H-AlN/4H-SiC(11 20) heterojunction2016

    • Author(s)
      Naoyuki Maejima, Masahiro Horita, Hirosuke Matsui, Tomohiro Matsushita, Hiroshi Daimon, and Fumihiko Matsui
    • Journal Title

      Japanese Journal of Applied Physics

      Volume: 55 Pages: 087501

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Photoelectron Holographic Atomic Arrangement Imaging of Cleaved Bimetal-intercalated Graphite Superconductor Surface2016

    • Author(s)
      Fumihiko Matsui, Ritsuko Eguchi, Saki Nishiyama, Masanari Izumi, Eri Uesugi, Hidenori Goto, Tomohiro Matsushita, Kenji Sugita, Hiroshi Daimon, Yuji Hamamoto, Ikutaro Hamada, Yoshitada Morikawa & Yoshihiro Kubozono
    • Journal Title

      Scientific Reports

      Volume: 6 Pages: 36258

    • DOI

      doi:10.1038/srep36258

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Short- and intermediate-range order in amorphous GeTe2016

    • Author(s)
      J. R. Stellhorn, S. Hosokawa, W.-C. Pilgrim, N. Blanc, N. Boudet, H. Tajiri, and S. Kohara
    • Journal Title

      Physica Status Solidi B

      Volume: 253 Pages: 1038-1045

    • DOI

      DOI: 10.1002/pssb.201552559

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Electronic structures of Pd30Pt17.5Cu32.5P20 bulk metallic glass2016

    • Author(s)
      S. Hosokawa, H. Sato, M. Nakatake, and N. Nishiyama
    • Journal Title

      Physica Status Solidi B

      Volume: 253 Pages: 676-682

    • DOI

      DOI: 10.1002/pssb.201552553

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] XAFS analysis on amorphous and crystalline new phase change material GeCu2Te32016

    • Author(s)
      K. Kamimura, S. Hosokawa, N. Happo, H. Ikemoto, Y. Sutou, S. Shindo, Y. Saito, and J. Koike
    • Journal Title

      Journal of Optoelectronics and Advanced Materials

      Volume: 18 Pages: 248-253

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] XAFS analysis of crystal GeCu2Te3 phase change material2016

    • Author(s)
      K. Kamimura, K. Kimura, S. Hosokawa, N. Happo, H. Ikemoto, Y. Sutou, S. Shindo, Y. Saito, and J. Koike
    • Journal Title

      Z. Phys. Chem.

      Volume: 230 Pages: 433-443

    • DOI

      DOI: https://doi.org/10.1515/zpch-2015-0672

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Structural aspects of the superionic conduction mechanism in Ag-GeSe3 glasses2016

    • Author(s)
      J. R. Stellhorn, S. Hosokawa, W.-C. Pilgrim, Y. Kawakita, K. Kamimura, K. Kimura, N. Blanc, and N. Boudet
    • Journal Title

      Z. Phys. Chem.

      Volume: 230 Pages: 369-386

    • DOI

      DOI: https://doi.org/10.1515/zpch-2015-0667

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] X-ray Fluorescence Holography for a TiNb Binary Alloy Consisting of the Martensite,2016

    • Author(s)
      T. Yamamoto, K. Hayashi, N. Happo, and S. Hosokawa
    • Journal Title

      Z. Phys. Chem.

      Volume: 230 Pages: 509-517

    • DOI

      DOI: https://doi.org/10.1515/zpch-2015-0670

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] X-ray Fluorescence Holographic Study on High-Temperature Superconductor FeSe0.4Te0.62016

    • Author(s)
      Y. Ideguchi, K. Kamimura, K. Kimura, S. Hosokawa, N. Happo, K. Hayashi, Y. Ebisu, T. Ozaki, J. R. Stellhorn, M. Suzuki, H. Okazaki, A. Yamashita, and Y. Takano
    • Journal Title

      Z. Phys. Chem.

      Volume: 230 Pages: 489-498

    • DOI

      DOI: https://doi.org/10.1515/zpch-2015-0671

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] A divalent rare earth oxide semiconductor: Yttrium monoxide2016

    • Author(s)
      K. Kaminaga, R. Sei, K. Hayashi, N. Happo, H. Tajiri, D. Oka, T. Fukumura, T. Hasegawa
    • Journal Title

      Applied Physics Letters

      Volume: 108 Pages: 122102

    • DOI

      doi: http://dx.doi.org/10.1063/1.4944330

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Large As sublattice distortion in sphalerite ZnSnAs2 thin films revealed by x-ray fluorescence holography2016

    • Author(s)
      K. Hayashi, N. Uchitomi, K. Yamagami, A. Suzuki, H. Yoshizawa, J.T. Asubar, N. Happo, and S. Hosokawa
    • Journal Title

      Journal of Applied Physics

      Volume: 119 Pages: 125703

    • DOI

      doi: http://dx.doi.org/10.1063/1.4945004

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Chemical and orbital fluctuations in Ba3CuSb2O92016

    • Author(s)
      Y. Wakabayashi, D. Nakajima, Y. Ishiguro, K. Kimura, T. Kimura, S. Tsutsui, A. Q. R. Baron, K. Hayashi, N. Happo, S. Hosokawa, K. Ohwada, and S. Nakatsuji
    • Journal Title

      Phys. Rev. B

      Volume: 93 Pages: 245117

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Development of an X-ray fluorescence holographic measurement systems for protein crystal2016

    • Author(s)
      A. Sato-Tomita, N. Shibayama, N. Happo, K. Kimura, T. Okabe, T. Matsushita, S.-Y Park, Y. C. Sasaki, K. Hayashi
    • Journal Title

      Review of Scientific Instruments

      Volume: 87 Pages: 063707

    • DOI

      doi: http://dx.doi.org/10.1063/1.4953453

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Electrostatic electron-doping yields superconductivity in LaOBiS22016

    • Author(s)
      E. Uesugi, S. Nishiyama, H. Goto, H. Ota, Y. Kubozono
    • Journal Title

      Appl. Phys. Lett.

      Volume: 109 Pages: 252601

    • DOI

      doi: http://dx.doi.org/10.1063/1.4972400

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Tranmsistor properties of 2,7-dialkyl-substituted phenanthro[2,1-b:7,8-b']dithiophene2016

    • Author(s)
      Y. Kubzoono, K. Hyodo, S. Hamao, Y. Shimo, H. Mori, Y. Nishihara
    • Journal Title

      Scientific Reports

      Volume: 6 Pages: 38535

    • DOI

      doi:10.1038/srep38535

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Superconductivity in (NH3)yNaxFeSe0.5Te0.52016

    • Author(s)
      L. Zheng, Y. Sakai, X. Miao, S. Nishiyama, T. Terao, R. Eguchi, H. Goto, Y. Kubozono
    • Journal Title

      Phys. Rev. B

      Volume: 94 Pages: 17405

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Photoelectron holographic atomic arrangement imaging of cleaved bimetal-intercalated graphite superconductor surface2016

    • Author(s)
      F. Matsui, R. Eguchi, S. Nishiyama, M. Izumi, E. Uesugi, H. Goto, T. Matsushita, K. Sugita, H. Daimon, Y. Hamamoto, I. Hamada, Y. Morikawa, Y. Kubozono
    • Journal Title

      Scientific Reports

      Volume: 6 Pages: 36528

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Chemical analysis of superconducting phase in K-doped picene2016

    • Author(s)
      T. Kambe, S. Nisiyama, H. L. T. Nguyen, T. Terao, M. Izumi, Y. Sakai, L. Zheng, H. Gotyo, Y. Ito, T. Onji, T. C. Kobayashi, H. Sugino, S. Gohda, H. Okamoto, Y. Kubozono
    • Journal Title

      J. Phys.: Condens. Matter

      Volume: 28 Pages: 444001

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Recent progress on carbon-based superconductors2016

    • Author(s)
      Y. Kubozono, R. Eguchi, H. Goto, S. Hamao, T. Kambe, T. Terqao, S. Nishiyama, L. Zheng, X. Miao, H. Okamoto
    • Journal Title

      J. Phys.: Condens. Matter

      Volume: 28 Pages: 334001

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Emergence of superconductivity in (NH3)yMxMoSe2 (M: +I, Na and K)2016

    • Author(s)
      X. Miao, S. Nishiyama, L. Zheng, H. Goto, R. Eguchi, H. Ota, T. Kambe, K. Terashima, T. Yokoya, H. T. L. Nguyen, T. Kagayama, N. Hirao, Y. Ohishi, H. Ishii, Y.-F. Liao, Y. Kubozono
    • Journal Title

      Scientific Reports 6, 29292 (2016)

      Volume: 6 Pages: 29292

    • DOI

      doi:10.1038/srep29292

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Correlation of superconductivity with crystal structure in (NH3)yCsxFeSe2016

    • Author(s)
      L. Zheng, X. Miao, Y. Sakai, H. Goto, E. Uesugi, R. Eguchi, S. Nishiyama, K. Sugimoto, A. Fujiwara, Y. Kubozono
    • Journal Title

      Physical Review B 93, 104508 (2016)

      Volume: 93 Pages: 104508

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Synthesis and transistor application of the extremely extended phenacene molecule, [9]phenacene2016

    • Author(s)
      Y. Shimo, T, Mikami, S. Hamao, H. Goto, H. Okamoto, R. Eguchi, S. Gohda, Y. Hayashi, Y. Kubozono
    • Journal Title

      Scientific Reports

      Volume: 6 Pages: 21008

    • DOI

      doi:10.1038/srep21008

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Applicability of Density Functional Tight Binding Method with Dispersion Correction to Investigate the Adsorption of Porphyrin/Porphycene Metal Complexes on Graphene”,2016

    • Author(s)
      Y. Kanematsu, K. Gohara, H. Yamada, and Y. Takano
    • Journal Title

      Chemistry Letters,

      Volume: 46 Pages: 51-52

    • DOI

      DOI: http://dx.doi.org/10.1246/cl.160887

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Synthesis and Characterization of an Iridium Triphyrin Complex”,2016

    • Author(s)
      S. Xue, D. Kuzuhara, N. Aratani, and H. Yamada
    • Journal Title

      Inorg. Chem.,

      Volume: 55 Pages: 10106-10109

    • DOI

      DOI: 10.1021/acs.inorgchem.6b01841

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Fullerene-linked tetrabenzoporphyrins for solution-processed organic photovoltaics: flexible vs. rigid linkers”,2016

    • Author(s)
      Y. Tamura, D. Kuzuhara, M. Suzuki, H. Hayashi, N. Aratani, H. Yamada
    • Journal Title

      J. Mater. Chem. A, 4

      Volume: 4 Pages: 15333-15342

    • DOI

      10.1039/C6TA06599F

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Bisanthra-thianthrene: synthesis, structure and oxidation propertie”,2016

    • Author(s)
      M. Yamashita, H. Hayashi, M. Suzuki, D. Kuzuhara*, J. Yuasa, T. Kawai, N. Aratani*, H. Yamada*
    • Journal Title

      RSC Advances,

      Volume: 6 Pages: 70700-70703

    • DOI

      10.1039/C6RA13036D

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Aromaticity Relocation in Perylene Derivatives upon Two-electron Oxidation to Form Anthracene and Phenanthrene”,2016

    • Author(s)
      A. Matsumoto, M. Suzuki, H. Hayashi, D. Kuzuhara, J. Yuasa, T. Kawai, N. Aratani and H. Yamada
    • Journal Title

      Chemistry - A European Journal,

      Volume: 22 Pages: 14462-14466

    • DOI

      DOI: 10.1002/chem.201602188

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Synthesis and Metalation of Doubly o-Phenylene-Bridged Cyclic Bis(dipyrrin)s with Highly Bent Skeleton of Dibenzoporphyrin(2.1.2.1)”,2016

    • Author(s)
      D. Kuzuhara, W. Furukawa, A. Kitashiro, N. Aratani, H. Yamada
    • Journal Title

      Chemistry - A European Journal

      Volume: 22 Pages: 10671-10678

    • DOI

      DOI: 10.1002/chem.201601083

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “A laterally π-expanded fluorone dye as an efficient near infrared fluorophore”,2016

    • Author(s)
      K. Sezukuri, M. Suzuki, H. Hayashi, D. Kuzuhara, N. Aratani and H. Yamada
    • Journal Title

      Chem. Commun., 52, 4872-4875 (2016)

      Volume: 52 Pages: 4872-4875

    • DOI

      10.1039/C6CC00237D

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Photoprecursor Approach Enables Preparation of Well-Performing Bulk-Heterojunction Layers Comprising a Highly Aggregating Molecular Semiconductor”,2016

    • Author(s)
      M. Suzuki, Y. Yamaguchi, K. Takahashi, K. Takahira, T. Koganezawa, S. Masuo,
    • Journal Title

      ACS Appl. Mater. Interfaces,

      Volume: 8 Pages: 8644-8651

    • DOI

      DOI: 10.1021/acsami.6b00345

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “One-pot Transformation of Levulinic Acid to 2-Methyltetrahydrofuran Catalyzed by Pt-Mo/H-beta in Water”2016

    • Author(s)
      T. Mizugaki, K. Togo, Z. Maeno, T. Mitsudome, K. Jitsukawa, K. Kaneda
    • Journal Title

      ACS Sustainable Chem. Eng.,

      Volume: 4 Pages: 682-685

    • DOI

      DOI: 10.1021/acssuschemeng.6b00181

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Green, Multi Gram One Step Synthesis of Core;Shell Nanocomposites in Water and Their Catalytic Application to Chemoselective Hydrogenations2016

    • Author(s)
      T. Urayama, T. Mitsudome, Z. Maeno, T. Mizugaki, K. Jitsukawa, K. Kaneda
    • Journal Title

      Chem. Eur. J., 22, 17962 -17966 (2016)

      Volume: 22 Pages: 17962-17966

    • DOI

      DOI: 10.1002/chem.201604763

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “On-demand Hydrogen Production from Organosilanes at Ambient Temperature Using Heterogeneous Gold Catalysts”2016

    • Author(s)
      T. Mitsudome, T. Urayama, T. Kiyohiro, Z. Maeno, T. Mizugaki, K. Jitsukawa, K. Kaneda
    • Journal Title

      Sci. Rep.,

      Volume: 6 Pages: 37682

    • DOI

      doi:10.1038/srep37682

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] “Photocatalytic oxygenation of sulfide and alkenes by trinuclear ruthenium clusters”2016

    • Author(s)
      S. Phungsripheng, K. Kozawa, M. Akita, A. Inagaki
    • Journal Title

      Inorg. Chem., 55, 3750-3758

      Volume: 55 Pages: 3750-3758

    • DOI

      DOI: 10.1021/acs.inorgchem.5b02518

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] “Ring-opening metathesis polymerization of cyclic olefins by (arylimido)vanadium(V)-alkylidenes: Highly active, thermally robust cis specific polymerization”2016

    • Author(s)
      X. Hou, K. Nomura
    • Journal Title

      J. Am. Chem. Soc.

      Volume: 138 Pages: 11840-11849

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Ru(0)-Catalyzed C3-Selective Cross-Dimerization of 2,5-Dihydrofuran with Conjugated Dienes2016

    • Author(s)
      *M. Hirano, Y. Hiroi, T. Murakami, H. Ogawa, S. Kioyta, N. Komine, S. Komiya
    • Journal Title

      Organometallics,

      Volume: 35 Pages: 1342-1346

    • DOI

      DOI: 10.1021/acs.organomet.5b00987

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Ru(0)-Catalyzed Direct Coupling of Internal Alkynes with Conjugated Dienes: An Efficient Access to Conjugated Trienes2016

    • Author(s)
      S. Kiyota, S. In, N. Komine, *M. Hirano
    • Journal Title

      Organometallics,

      Volume: 35 Pages: 4033-4043

    • DOI

      DOI: 10.1021/acs.organomet.6b00668

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Experimental determination of dependence of vertical growth rate on surface supersaturation in GaAs(001) microchannel epitaxy and growth optimization2016

    • Author(s)
      M. Tomita, Y. Mizuno, H. Takakura, D. Kambayashi, *S. Naritsuka, T. Maruyama
    • Journal Title

      J. Cryst. Growth

      Volume: 440 Pages: 13-16

    • DOI

      http://doi.org/10.1016/j.jcrysgro.2016.01.030

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Optical pump-THz probe analysis of long-lived d-electrons and relaxation to self-trapped exciton states in MnO2016

    • Author(s)
      *J. Nishitani, T. Nagashima, M. Lippmaa, T. Suemoto
    • Journal Title

      Appl. Phys. Lett.

      Volume: 108 Pages: 162101-1-5

    • DOI

      http://dx.doi.org/10.1063/1.4946992

    • Peer Reviewed / Open Access / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Superconducting coupling across a spin-filtering manganite tunnel barrier with magnetic disorder2016

    • Author(s)
      T. Harada, M. Matvejeff, R. Takahashi, *M. Lippmaa
    • Journal Title

      Europhys. Lett.

      Volume: 115 Pages: 67005-1-5

    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Two dimensional superconductivity emerged at monatomic Bi2- square net in layered Y2O2Bi via oxygen incorporation2016

    • Author(s)
      R. Sei, S. Kitani, *T. Fukumura, H. Kawaji, T. Hasegawa
    • Journal Title

      J. Am. Chem. Soc.

      Volume: 138 Pages: 11085-11088

    • DOI

      10.1021/jacs.6b05275

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Effect of N2 microplasma treatment on initial growth of GaN by metal-organic molecular beam epitaxy2016

    • Author(s)
      Y. Suzuki, Y. Kusakabe, S. Uchiyama, T. Maruyama, *S. Naritsuka, K. Shimizu
    • Journal Title

      Jpn. J. Appl. Phys.

      Volume: 55 Pages: 081002

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Microchannel epitaxy2016

    • Author(s)
      *S. Naritsuka
    • Journal Title

      Prog. Cryst. Growth Charact. Mater.

      Volume: 62 Pages: 302-316

    • DOI

      http://doi.org/10.1380/jsssj.21.320

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Journal Article] Direct growth of multilayer graphene by precipitation method using W capping layer2016

    • Author(s)
      J. Yamada, Y. Ueda, T. Maruyama, *S. Naritsuka
    • Journal Title

      Jpn. J. Appl. Phys.

      Volume: 55 Pages: 100302-1-4

    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] Lateral growth of GaN by liquid phase electroepitaxy using mesa-shaped substrate2016

    • Author(s)
      D. Kambayashi, H. Takakura, M. Tomita, M. Iwakawa, Y. Mizuno, T. Maruyama, *S. Naritsuka
    • Journal Title

      Jpn. J. Appl. Phys.

      Volume: 55 Pages: 105502-1-4

    • DOI

      10.7567/JJAP.55.105502

    • Peer Reviewed / Open Access / Acknowledgement Compliant
  • [Presentation] High-Speed Characterization of Surface, Interface, and Thinfilm Structures by Using Multi-Wavelength Dispersive X-ray Diffraction2017

    • Author(s)
      T. Shirasawa
    • Organizer
      The 5th Annual Conference of AnalytiX-2017
    • Place of Presentation
      Hilton Fukuoka SeaHawk(福岡県福岡市)
    • Year and Date
      2017-03-22 – 2017-03-24
    • Int'l Joint Research / Invited
  • [Presentation] 3D Observation of Atomic and Electronic Structure by Two-dimensional Photoelectron Spectroscopy2017

    • Author(s)
      Hiroshi Daimon
    • Organizer
      Seminar at Institute of Physics, Martin-Luther-Universit&228;t Halle-Wittenberg
    • Place of Presentation
      Institute of Physics, Martin-Luther-Universit&28;t Halle-Wittenberg
    • Year and Date
      2017-03-13
    • Invited
  • [Presentation] Superconductivity induced by electron-doping of 2D layered materials2017

    • Author(s)
      Yoshihiro Kubozono
    • Organizer
      Kick-off meeting of Program for Advancing Strategic International Networks to Accelerate the Circulation of Talented Researchers
    • Place of Presentation
      岡山大学(岡山県岡山市)
    • Year and Date
      2017-02-28 – 2017-03-01
    • Int'l Joint Research / Invited
  • [Presentation] “(Imido)vanadium(V)-alkylidene complexes: Highly active,thermally robust, cis specific ring-opening metathesis polymerization catalysts”2017

    • Author(s)
      K. Nomura
    • Organizer
      3rd International Conference on Molecular & Functional Catalysis (ICMFC-3)
    • Place of Presentation
      Singapore
    • Year and Date
      2017-02-28
    • Int'l Joint Research / Invited
  • [Presentation] “(Imido)vanadium complexes containing anionic ancillary donor ligands as efficient catalysts for olefin polymerization/dimerization”2017

    • Author(s)
      K. Nomura
    • Organizer
      Institute of Chemistry, Chinese Academy of Sciences
    • Place of Presentation
      Beijing, China
    • Year and Date
      2017-02-11
    • Int'l Joint Research / Invited
  • [Presentation] “Design and synthesis of highly active olefin metathesis vanadium-alkylidene catalysts”2017

    • Author(s)
      K. Nomura
    • Organizer
      11th Pure and Applied Chemistry International Conference 2017 (PACCON 2017)
    • Place of Presentation
      Bangkok, Thailand
    • Year and Date
      2017-02-02
    • Int'l Joint Research / Invited
  • [Presentation] 3D atomic arrangement analysis around active center atom of catalysis using atomic resolution holography2016

    • Author(s)
      Hiroshi Daimon
    • Organizer
      the International Symposium on Dynamic Process of Chemical Reaction and Catalysis on Surfaces
    • Place of Presentation
      Xiamen University(中国廈門市)
    • Year and Date
      2016-12-23
  • [Presentation] デバイス高性能化に向けたSi中ドーパントサイトの研究2016

    • Author(s)
      筒井 一生
    • Organizer
      物性研究所短期研究会「原子層上の活性サイトで発現する局所機能物性」
    • Place of Presentation
      東京大学物性研究所(千葉県柏市)
    • Year and Date
      2016-12-21
    • Int'l Joint Research / Invited
  • [Presentation] MoS2のデバイス応用2016

    • Author(s)
      若林 整
    • Organizer
      物性研究所短期研究会「原子層上の活性サイトで発現する局所機能物性」
    • Place of Presentation
      東京大学物性研究所(千葉県柏市)
    • Year and Date
      2016-12-21
    • Int'l Joint Research / Invited
  • [Presentation] "X-ray fluorescence holographic study on high-temperature superconductor FeSe0.4Te0.6 K. Hayashi "2016

    • Author(s)
      K. Hayashi
    • Organizer
      International Workshop on Superconductivity and Related Functional Materials
    • Place of Presentation
      物質材料研究機構(茨城県つくば市)
    • Year and Date
      2016-12-21
    • Int'l Joint Research / Invited
  • [Presentation] "Bi2- square net superconductivity in Y2O2Bi"2016

    • Author(s)
      T. Fukumura
    • Organizer
      29th International Superconductivity Symposium (ISS2016)
    • Place of Presentation
      東京国際フォーラム(東京都千代田区)
    • Year and Date
      2016-12-14
    • Int'l Joint Research / Invited
  • [Presentation] 光電子ホログラフィーによる Si 中ドーパントサイトの研究2016

    • Author(s)
      筒井 一生
    • Organizer
      第10回物性科学領域横断研究会
    • Place of Presentation
      神戸大学六甲第二キャンパス(兵庫県神戸市)
    • Year and Date
      2016-12-09
    • Int'l Joint Research / Invited
  • [Presentation] IoTのセンサ~通信~ビッグデータ処理過程を支えるデバイス・周辺技術2016

    • Author(s)
      若林 整
    • Organizer
      日本学術振興会 半導体界面制御技術 第154委員会 第8回講習会
    • Place of Presentation
      東大・武田先端知ビル(東京都文京区)
    • Year and Date
      2016-11-29
    • Int'l Joint Research / Invited
  • [Presentation] Xenon plays inhibition roles on the neuronal network activities2016

    • Author(s)
      T. Uchida
    • Organizer
      2nd International Aquaphotomics Symposium
    • Place of Presentation
      神戸大学(兵庫県神戸市)
    • Year and Date
      2016-11-28
    • Int'l Joint Research / Invited
  • [Presentation] Neutron holography for local structure analysis using neutron scattering nature2016

    • Author(s)
      K. Hayashi
    • Organizer
      The International Symposium of Quantum Beam Science at Ibaraki University
    • Place of Presentation
      茨城大学(茨城県水戸市)
    • Year and Date
      2016-11-19
    • Int'l Joint Research / Invited
  • [Presentation] "Concerted catalysis between metal complex and organic functionality immobilized on same SiO2 surface"2016

    • Author(s)
      K. Motokurta
    • Organizer
      International Symposium on Catalysis and Fine Chemicals 2016 (C&FC2016)
    • Place of Presentation
      Taipei,China
    • Year and Date
      2016-11-12
    • Int'l Joint Research / Invited
  • [Presentation] "Cross-dimerization using unsaturated five-membered heterocyclic compounds"2016

    • Author(s)
      M. Hirano
    • Organizer
      International Symposium on Catalysis and Fine Chemicals 2016 (C&FC2016)
    • Place of Presentation
      Taipei,China
    • Year and Date
      2016-11-12
    • Int'l Joint Research / Invited
  • [Presentation] “Precise synthesis of end-functionalized conjugated (block) polymers for integration of functionality by olefin metathesis”2016

    • Author(s)
      K. Nomura
    • Organizer
      International Symposium on Catalysis and Fine Chemicals 2016 (C&FC2016)
    • Place of Presentation
      Taipei,China
    • Year and Date
      2016-11-12
    • Int'l Joint Research / Invited
  • [Presentation] 3D atomic image reconstruction algorithm for photoelectron holography and x- ray fluorescence holography2016

    • Author(s)
      T. Matsushita
    • Organizer
      3rd International Symposium on Kumamoto Synchrotron Radiation (ISKSR3)
    • Place of Presentation
      Kumamoto Univ.(熊本県熊本市)
    • Year and Date
      2016-11-11
    • Int'l Joint Research / Invited
  • [Presentation] 3D Atomic Arrangement Analysis Around Specific Atoms by Atomic Resolution Holography2016

    • Author(s)
      Hiroshi Daimon
    • Organizer
      IWAMSN2016
    • Place of Presentation
      Grand Halong Hotel(Vietnam,Halong)
    • Year and Date
      2016-11-11
    • Int'l Joint Research / Invited
  • [Presentation] “Precise synthesis of cyclic olefin polymers by olefin insertion/metathesis polymerization”2016

    • Author(s)
      K. Nomura
    • Organizer
      National Taiwan University of Science and Technology
    • Place of Presentation
      Taiwan,China
    • Year and Date
      2016-11-09
    • Int'l Joint Research / Invited
  • [Presentation] “(Imido)vanadium complexes containing anionic ancillary donor ligands as efficient catalysts for olefin polymerization/dimerization”2016

    • Author(s)
      K. Nomura
    • Organizer
      10th International Vanadium Symposium: Chemistry, Biological Chemistry, & Toxicology (V10)
    • Place of Presentation
      Taipei,China
    • Year and Date
      2016-11-07
    • Int'l Joint Research / Invited
  • [Presentation] First-principles theoretical study on chemical reactions at surfaces and interfaces related to energy and environmental problems.2016

    • Author(s)
      Y. Morikawa
    • Organizer
      International Workshop on Advanced Materials and Nanotechnology 2016 (IWAMN 2016)
    • Place of Presentation
      Ha Noi, Vietnam
    • Year and Date
      2016-11-03 – 2016-11-05
    • Int'l Joint Research / Invited
  • [Presentation] 3D Atomic Arrangement Around Specific Atoms Studied by Atomic Resolution Holography and Stereography2016

    • Author(s)
      Hiroshi Daimon
    • Organizer
      InJoSy-5
    • Place of Presentation
      NTHU, Taiwan
    • Year and Date
      2016-10-28
    • Int'l Joint Research / Invited
  • [Presentation] Large-scale DFT simulations with a linear-scaling DFT code Conquest on K-computer2016

    • Author(s)
      T. Miyazaki
    • Organizer
      International Conference on Simulation Technology (JSST2016)
    • Place of Presentation
      Kyoto Univ.(京都府京都市)
    • Year and Date
      2016-10-27 – 2016-10-29
    • Int'l Joint Research / Invited
  • [Presentation] First-principles Simulations on Chemical Reactions at Surfaces and Interfaces Related to Energy and Environmental Problems2016

    • Author(s)
      Yoshitada Morikawa
    • Organizer
      1st International Conference on Physical Instrumentation and Advanced Materials
    • Place of Presentation
      Surabaya, Indonesia
    • Year and Date
      2016-10-27
    • Int'l Joint Research / Invited
  • [Presentation] “Pd(0)-Catalyzed successive C-O/C-H bond activation of 2-substituted benzyl esters”2016

    • Author(s)
      M. Hirano
    • Organizer
      International Symposium on C-O Activation
    • Place of Presentation
      Himeji Chamber of Commerce and Industry(兵庫県姫路市)
    • Year and Date
      2016-10-25
    • Int'l Joint Research / Invited
  • [Presentation] 3D Visualizations of Local Structures around Specific Elements with Atomic Resolution Holography2016

    • Author(s)
      K. Hayashi
    • Organizer
      NITech International Symposium, Advanced Functional Materials and Application
    • Place of Presentation
      名古屋工業大学(愛知県名古屋市)
    • Year and Date
      2016-10-17
    • Int'l Joint Research / Invited
  • [Presentation] Scientific Evolution of Time-Resolved Local Structure Imaging by Micro-Photoelectron Holography and Photoemission Electron Microscope at SPring-82016

    • Author(s)
      Toyohiko Kinoshita
    • Organizer
      EMN Ultrafast 2016,
    • Place of Presentation
      Merbolune,Australia
    • Year and Date
      2016-10-13
    • Int'l Joint Research / Invited
  • [Presentation] DFT simulations on million-atom systems using a linear-scaling DFT code CONQUEST2016

    • Author(s)
      T. Miyazaki
    • Organizer
      EMN Meeting on Computation and Theory 2016
    • Place of Presentation
      SOUTH POINT HOTEL, CASINO & SPA,Las Vegas ,United States
    • Year and Date
      2016-10-10 – 2016-10-15
    • Int'l Joint Research / Invited
  • [Presentation] First-Principles Study on Electron Conduction at 4H-SiC(0001)/SiO2 Interface2016

    • Author(s)
      T. Ono
    • Organizer
      Pacific Rim Meeting on Electrochemical and Solid-State Science 2016
    • Place of Presentation
      Honolulu, USA
    • Year and Date
      2016-10-02 – 2016-10-07
    • Int'l Joint Research / Invited
  • [Presentation] High-performance field-effect transistors using phenacene-type molecules and their application toward logic gate circuits2016

    • Author(s)
      Yoshihiro Kubozono
    • Organizer
      EMN Organic and Photonics Meeting
    • Place of Presentation
      San Sebastian, Spain
    • Year and Date
      2016-09-14
    • Int'l Joint Research / Invited
  • [Presentation] 量子化と歪みでシリコンはどこまで変わるのか?-基礎物性の立場から2016

    • Author(s)
      武田 さくら
    • Organizer
      第77回応用物理学会秋季学術講演会
    • Place of Presentation
      朱鷺メッセ(新潟県新潟市)
    • Year and Date
      2016-09-13
    • Int'l Joint Research / Invited
  • [Presentation] Quick Characterization of Surface, Interface, and Epitaxial Thinfilm by Rainbow X-ray Diffraction2016

    • Author(s)
      T. Shirasawa
    • Organizer
      Energy Materials Nanotechnology Collaborative Conference on Crystal Growth 2016
    • Place of Presentation
      スペイン・サンセバスティアン
    • Year and Date
      2016-09-04 – 2016-09-08
    • Int'l Joint Research / Invited
  • [Presentation] Photoelectron holography and stereophotography of atomic arrangement using circularly polarized synchrotron radiation2016

    • Author(s)
      Hiroshi Daimon
    • Organizer
      A Voyage Through Four Generations of Synchrotron Radiation Research
    • Place of Presentation
      Lawrence Berkeley National Lab(Berkeley,USA)
    • Year and Date
      2016-09-02
    • Int'l Joint Research / Invited
  • [Presentation] Mechanistic Study on Iron-Catalyzed Cross-Coupling Reaction Illuminated by Solution-Phase XAS Analysis2016

    • Author(s)
      H. Takaya
    • Organizer
      Base Metal Catalysis Symposium
    • Place of Presentation
      Prinston Univ, USA
    • Year and Date
      2016-09-02
    • Int'l Joint Research / Invited
  • [Presentation] “(Imido)vanadium complexes as efficient catalysts for olefin insertion/metathesis reactions”2016

    • Author(s)
      K. Nomura
    • Organizer
      East China University of Science and Technology
    • Place of Presentation
      Shanghai, China
    • Year and Date
      2016-08-25
    • Int'l Joint Research / Invited
  • [Presentation] “(Imido)vanadium complexes as efficient catalysts for olefin insertion/metathesis reactions”2016

    • Author(s)
      K. Nomura
    • Organizer
      Shanghai Institute of Organic Chemistry (SIOC), Chinese Academy of Sciences
    • Place of Presentation
      Shanghai, China
    • Year and Date
      2016-08-24
    • Int'l Joint Research / Invited
  • [Presentation] New Superconductors formed by electron doping of two-dimensional layered materials2016

    • Author(s)
      Yoshihiro Kubozono
    • Organizer
      European Materials Congress
    • Place of Presentation
      Stockholm,Sweden
    • Year and Date
      2016-08-23 – 2016-08-25
    • Int'l Joint Research / Invited
  • [Presentation] “Precise synthesis of cyclic olefin polymers by olefin insertion/metathesis polymerization”2016

    • Author(s)
      K. Nomura
    • Organizer
      Donghua University
    • Place of Presentation
      Shanghai, China
    • Year and Date
      2016-08-23
    • Int'l Joint Research / Invited
  • [Presentation] “Precise synthesis of cyclic olefin polymers by olefin insertion/metathesis polymerization”2016

    • Author(s)
      K. Nomura
    • Organizer
      University of Science and Technology of China
    • Place of Presentation
      Hefei, China
    • Year and Date
      2016-08-22
    • Int'l Joint Research / Invited
  • [Presentation] Structures of low dimensional metallic over-layers on Si substrate2016

    • Author(s)
      Tadashi Abukawa
    • Organizer
      IBS conference on Surface Atomic Wires
    • Place of Presentation
      Pohang, Korea
    • Year and Date
      2016-08-17 – 2016-08-20
  • [Presentation] “Design and synthesis of (imido)vanadium(V)-alkylidene complexes as efficient catalysts for ring-opening metathesis polymerization (ROMP) of cyclic olefins”2016

    • Author(s)
      K. Nomura
    • Organizer
      International Symposium on Pure and Applied Chemistry 2016 (ISPAC2016)
    • Place of Presentation
      Kuching, Sarawak, Malaysia,
    • Year and Date
      2016-08-16
    • Int'l Joint Research / Invited
  • [Presentation] Surface structure analyses of organic device materials2016

    • Author(s)
      Y.Wakabayashi
    • Organizer
      XXV International Materials Research Congress
    • Place of Presentation
      Cancun,Mexico
    • Year and Date
      2016-08-14 – 2016-08-18
    • Int'l Joint Research / Invited
  • [Presentation] ”CMOS-Device Benchmark and Sputtered MoS2 Film for Monolithic Transistor”2016

    • Author(s)
      H. Wakabayashi
    • Organizer
      20th International Symposium on Chemical-Mechanical Planarization
    • Place of Presentation
      Lake Placid, NY, USA
    • Year and Date
      2016-08-07 – 2016-08-10
    • Int'l Joint Research / Invited
  • [Presentation] "Michrochannel Epitaxy"2016

    • Author(s)
      S. Naritsuka
    • Organizer
      The 16th International Summer School of Crystal Growth
    • Place of Presentation
      Doshisha Biwako Retrea Center(滋賀県大津市)
    • Year and Date
      2016-08-01 – 2016-08-07
    • Int'l Joint Research / Invited
  • [Presentation] “Design of visible-light-active photocatalysts for molecular transformation of organic compounds”2016

    • Author(s)
      A. Inagaki
    • Organizer
      20th International Symposium on Homogeneous Catalysis (ISHCXX)
    • Place of Presentation
      京都テルサ(京都府京都市)
    • Year and Date
      2016-07-14
    • Int'l Joint Research / Invited
  • [Presentation] “Precise synthesis of end-functionalized liner/star conjugated (block) polymers for integration of functionality by olefin metathesis”2016

    • Author(s)
      K. Nomura
    • Organizer
      9th International Symposium on High-tech Polymer Materials (HTPM-9)
    • Place of Presentation
      Zhengzhou, China
    • Year and Date
      2016-07-12
    • Int'l Joint Research / Invited
  • [Presentation] 3D atomic structure analysis around local active atoms by two-dimensional photoelectron diffraction and holography2016

    • Author(s)
      Hiroshi Daimon
    • Organizer
      MS Nano conference
    • Place of Presentation
      University of Rennes(Rennes,France)
    • Year and Date
      2016-07-02
    • Int'l Joint Research / Invited
  • [Presentation] Applications of X-ray fluorescence holography &8211;Lattice distortions and dopants-2016

    • Author(s)
      K. Hayashi
    • Organizer
      Local 3D atomic and electronic structure imaging of functionally active sites
    • Place of Presentation
      Zurich, Switzerland
    • Year and Date
      2016-07-01
    • Int'l Joint Research / Invited
  • [Presentation] 3D active site science 3D atomic structure analysis around local active site atoms by holography2016

    • Author(s)
      Hiroshi Daimon
    • Organizer
      Local 3D atomic and electronic structure imaging of functionally active sites(VUVX Satellite)(
    • Place of Presentation
      University of Zurich,Switzerland
    • Year and Date
      2016-07-01
    • Int'l Joint Research / Invited
  • [Presentation] Diffraction Spectroscopy as an alternative way of using photoelectron diffraction2016

    • Author(s)
      Fumihiko Matsui, Tomohiro Matsushita, Hiroshi Daimon, Matthias Muntwiler, Thomas Greber
    • Organizer
      Local 3D atomic and electronic structure imaging of functionally active sites(VUVX Satellite)(
    • Place of Presentation
      University of Zurich,Switzerland
    • Year and Date
      2016-07-01
    • Int'l Joint Research / Invited
  • [Presentation] “Precise olefin metathesis: Effective methods for synthesis of new conjugated materials by integration of functionality”2016

    • Author(s)
      K. Nomura
    • Organizer
      PERCH &8211; CIC Congress IX
    • Place of Presentation
      Pattaya, Thailand
    • Year and Date
      2016-06-27
    • Int'l Joint Research / Invited
  • [Presentation] Density functional theory study on transport property of nanomaterials2016

    • Author(s)
      T. Ono
    • Organizer
      5th International Conference from Nanoparticles and Nanomaterials to Nanodevices and Nanosystems (IC4N)
    • Place of Presentation
      Porto Heli, Greece
    • Year and Date
      2016-06-26 – 2016-06-30
    • Int'l Joint Research / Invited
  • [Presentation] Superconductivity in two-dimensional layered materials through electron-doping by metal intercalation and electrostatic techniques2016

    • Author(s)
      Yoshihiro Kubozono
    • Organizer
      Superstripes 2016
    • Place of Presentation
      Ischia, Italy
    • Year and Date
      2016-06-23 – 2016-06-29
    • Int'l Joint Research / Invited
  • [Presentation] Density functional theory study on transport property of nanomaterials2016

    • Author(s)
      T. Ono
    • Organizer
      5th International Conference from Nanoparticles and Nanomaterials to Nanodevices and Nanosystems (IC4N)
    • Place of Presentation
      Porto Heli Greece
    • Year and Date
      2016-06-20 – 2016-06-30
    • Int'l Joint Research / Invited
  • [Presentation] Metal-Array Fabrication based on Metalated Amino Acids/Peptides: Application to Supramolecular Catalyst2016

    • Author(s)
      H. Takaya
    • Organizer
      China-Japan International Symposium on Polymer and Related Materials
    • Place of Presentation
      Harbin Eng. Univ, China
    • Year and Date
      2016-06-11
    • Int'l Joint Research / Invited
  • [Presentation] Phonon excitations in Pd42.5Ni7.5Cu30P20 bulk metallic glass by inelastic x-ray scattering2016

    • Author(s)
      S. Hosokawa,
    • Organizer
      International Conference on Processing and Manufacturing of Advances Materials - Processing, Fabrication, Properties, Applications - THERMEC‘2016
    • Place of Presentation
      Graz,Austlia
    • Year and Date
      2016-05-29 – 2016-06-03
  • [Presentation] Fabrication of novel superconductor materials by electron-doping of 2D-layered inorganic and organic materials2016

    • Author(s)
      Yoshihiro Kubozono
    • Organizer
      Croatia Meeting for Energy Materials and Nanotechnology
    • Place of Presentation
      Dubrovnik Croatia
    • Year and Date
      2016-05-04 – 2016-05-07
    • Int'l Joint Research / Invited
  • [Presentation] Large scale ab initio simulations for functional materials: the CONQUEST code2016

    • Author(s)
      T. Miyazaki
    • Organizer
      E-MRS 2016 Spring Meeting
    • Place of Presentation
      Lille Grand Palais,Lille,France
    • Year and Date
      2016-05-02 – 2016-05-06
    • Int'l Joint Research / Invited
  • [Presentation] Million-atom DFT simulations with the CONQUEST code2016

    • Author(s)
      T. Miyazaki
    • Organizer
      Thomas Young Centre International Symposium: From statistical mechanics to quantum mechanics
    • Place of Presentation
      University College London, London, UK
    • Year and Date
      2016-04-28
    • Int'l Joint Research / Invited
  • [Book] Zeitschrift für Physikalische Chemie,Element Specific Structure Determination in Materials on Nanometer and Sub-Nanometer Scales using modern X-Ray and Neutron Techniques"2016

    • Author(s)
      Wolf-Christian Pilgrim,Shinya Hosokawa,Koichi Hayashi,Pawel Korecki
    • Total Pages
      146
    • Publisher
      Rademann, Klaus
  • [Book] 機能構造科学入門-3D活性サイトと物質デザイン2016

    • Author(s)
      大門寛、佐々木裕次
    • Total Pages
      166
    • Publisher
      丸善出版
  • [Remarks] 新学術領域研究「3D活性サイト科学」

    • URL

      http://www.3d-activesite.jp/home

  • [Remarks] YouTube新学術領域研究「3D活性サイト科学」

    • URL

      https://www.youtube.com/channel/UChw9VgK5N5Lx7O2hrj6QzBA

  • [Remarks] 3D Active-Site Science

    • URL

      www.3d-activesite.jp/

  • [Funded Workshop] SSNS'162017

    • Place of Presentation
      新富良野プリンスホテル
    • Year and Date
      2017-01-11 – 2017-01-15
  • [Funded Workshop] VUVX2016 satellite workshop "Local 3D atomic and electronic structure imaging of functionally active sites"2016

    • Place of Presentation
      Zurich大学
    • Year and Date
      2016-07-03 – 2016-07-08

URL: 

Published: 2018-01-16   Modified: 2022-10-19  

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