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Ab initio simulation study on attosecond photoemission delay

Research Project

Project/Area Number 16H03881
Research Category

Grant-in-Aid for Scientific Research (B)

Allocation TypeSingle-year Grants
Section一般
Research Field Optical engineering, Photon science
Research InstitutionThe University of Tokyo

Principal Investigator

Ishikawa Kenichi  東京大学, 大学院工学系研究科(工学部), 教授 (70344025)

Co-Investigator(Kenkyū-buntansha) 佐藤 健  東京大学, 大学院工学系研究科(工学部), 准教授 (30507091)
Project Period (FY) 2016-04-01 – 2019-03-31
Project Status Completed (Fiscal Year 2018)
Budget Amount *help
¥10,660,000 (Direct Cost: ¥8,200,000、Indirect Cost: ¥2,460,000)
Fiscal Year 2018: ¥2,080,000 (Direct Cost: ¥1,600,000、Indirect Cost: ¥480,000)
Fiscal Year 2017: ¥2,080,000 (Direct Cost: ¥1,600,000、Indirect Cost: ¥480,000)
Fiscal Year 2016: ¥6,500,000 (Direct Cost: ¥5,000,000、Indirect Cost: ¥1,500,000)
Keywordsアト秒科学 / 第一原理計算 / 極紫外自由電子レーザー / 角度分解光電子分光 / 光電子放出遅延 / 自由電子レーザー / 応用光学・量子光工学 / 量子エレクトロニクス
Outline of Final Research Achievements

Recent developments in high-order harmonic generation and free-electron lasers have enabled to generate attosecond-to-femtosecond laser pulses in the extreme-ultraviolet (XUV) range. In this study, we have studied photoemission from Ne using first-principles simulations. First, we have numerically implemented the infinite-range exterior complex scaling as an efficient absorbing boundary to the time-dependent complete-active-space self-consistent field method for multielectron atoms. Next, We have numerically implemented the time-dependent surface flux method, an efficient computational scheme to extract photoelectron energy spectra. Then, we have simulated the coherent-control experiment conducted in the XUV free-electron laser FERMI, where Ne was ionized by two-color XUV pulses and the photoelectron angular distribution (PAD) was measured. Our simulation have excellently reproduced the dependence of PAD on the relative phase between the two colors.

Academic Significance and Societal Importance of the Research Achievements

本研究の成果を通じて、高強度レーザーパルスや超短パルスコヒーレント極紫外パルスによる、数十もの電子を含む原子の光イオン化を第一原理的にシミュレーションすることが可能になった。計算によって得られるイオン化の収率や角度分解光電子エネルギースペクトルは数値的に厳密なものであり、実験との一致はみごとで、実験で観測される様々な現象のメカニズム等に関する理解の深化に貢献できる。数年前には夢物語と思われた第一原理シミュレーションを実現したといえ、アト秒~フェムト秒極紫外パルスを使って電子ダイナミクスを観測・制御する技術の発展に、大きく寄与すると期待される。

Report

(4 results)
  • 2018 Annual Research Report   Final Research Report ( PDF )
  • 2017 Annual Research Report
  • 2016 Annual Research Report
  • Research Products

    (52 results)

All 2019 2018 2017 2016 Other

All Int'l Joint Research (8 results) Journal Article (11 results) (of which Int'l Joint Research: 4 results,  Peer Reviewed: 11 results,  Open Access: 3 results,  Acknowledgement Compliant: 3 results) Presentation (30 results) (of which Int'l Joint Research: 27 results,  Invited: 27 results) Book (1 results) Remarks (2 results)

  • [Int'l Joint Research] フェルミ自由電子レーザー/エレットラシンクロトロン(イタリア)

    • Related Report
      2018 Annual Research Report
  • [Int'l Joint Research] モスクワ大学(ロシア連邦)

    • Related Report
      2018 Annual Research Report
  • [Int'l Joint Research] ミュンヘン大学(ドイツ)

    • Related Report
      2017 Annual Research Report
  • [Int'l Joint Research] ウィーン工科大学(オーストリア)

    • Related Report
      2017 Annual Research Report
  • [Int'l Joint Research] フェルミ自由電子レーザー(イタリア)

    • Related Report
      2017 Annual Research Report
  • [Int'l Joint Research] ミュンヘン大学(ドイツ)

    • Related Report
      2016 Annual Research Report
  • [Int'l Joint Research] ウィーン工科大学(オーストリア)

    • Related Report
      2016 Annual Research Report
  • [Int'l Joint Research] フェルミ自由電子レーザー(イタリア)

    • Related Report
      2016 Annual Research Report
  • [Journal Article] High-harmonic generation enhanced by laser-induced electron recollision2019

    • Author(s)
      Y. Li, T. Sato, and K. L. Ishikawa
    • Journal Title

      Phys. Rev. A

      Volume: 99 Issue: 4 Pages: 043401-043401

    • DOI

      10.1103/physreva.99.043401

    • Related Report
      2018 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Gauge Invariance beyond the Electric Dipole Approximation2018

    • Author(s)
      R. Anzaki*, Y. Shinohara, T. Sato, and K. L. Ishikawa
    • Journal Title

      Phys. Rev. A

      Volume: 98 Issue: 6 Pages: 063410-063410

    • DOI

      10.1103/physreva.98.063410

    • Related Report
      2018 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Time-dependent optimized coupled-cluster method for multielectron dynamics2018

    • Author(s)
      T. Sato, H. Pathak, Y. Orimo, and K. L. Ishikawa
    • Journal Title

      Journal of Chemical Physics

      Volume: 148 Issue: 5

    • DOI

      10.1063/1.5020633

    • Related Report
      2017 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Gauge-Invariant Formulation of Time-Dependent Configuration Interaction Singles Method2018

    • Author(s)
      Sato Takeshi、Teramura Takuma、Ishikawa Kenichi
    • Journal Title

      Appl. Sci.

      Volume: 8 Issue: 3 Pages: 433-433

    • DOI

      10.3390/app8030433

    • Related Report
      2017 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Observation and Control of Laser-Enabled Auger Decay2017

    • Author(s)
      D. Iablonskyi, K. Ueda, K. L. Ishikawa, A. S. Kheifets, P. Carpeggiani, M. Reduzzi, H. Ahmadi, A. Comby, G. Sansone, T. Csizmadia, S. Kuehn, E. Ovcharenko, T.Mazza, M. Meyer, A. Fischer, C. Callegari, O. Plekan, P. Finetti, E. Allaria, E. Ferrari, E. Roussel, D. Gauthier, L. Giannessi, and K. C. Prince
    • Journal Title

      Phys. Rev. Lett.

      Volume: 119 Issue: 7

    • DOI

      10.1103/physrevlett.119.073203

    • Related Report
      2017 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] Fully General Time-Dependent Multiconfiguration Self-Consistent-Field Method for the Electron-Nuclear Dynamics2017

    • Author(s)
      Ryoji Anzaki, Takeshi Sato, Kenichi L. Ishikawa
    • Journal Title

      Phys. Chem. Chem. Phys.

      Volume: 19 Issue: 33 Pages: 22008-22015

    • DOI

      10.1039/c7cp02086d

    • Related Report
      2017 Annual Research Report
    • Peer Reviewed / Open Access
  • [Journal Article] Implementation of the infinite-range exterior complex scaling to the time-dependent complete-active-space self-consistent-field method2017

    • Author(s)
      Yuki Orimo, Takeshi Sato, Armin Scrinzi, and Kenichi L. Ishikawa
    • Journal Title

      Phys.Rev. A

      Volume: 97 Issue: 2

    • DOI

      10.1103/physreva.97.023423

    • Related Report
      2017 Annual Research Report
    • Peer Reviewed / Int'l Joint Research
  • [Journal Article] High-harmonic spectra from time-dependent two-particle reduced-density-matrix theory2017

    • Author(s)
      F. Lackner, I. Bresinova, T. Sato, K. L. Ishikawa, and J. Burgdorfer
    • Journal Title

      Physical Review A

      Volume: 95 Issue: 3

    • DOI

      10.1103/physreva.95.033414

    • Related Report
      2016 Annual Research Report
    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Journal Article] Trajectory analysis of high-order-harmonic generation from periodic crystals2017

    • Author(s)
      T. Ikemachi, Y. Shinohara, T. Sato, J. Yumoto, M. Kuwata-Gonokami, and K. L. Ishikawa
    • Journal Title

      Physical Review A

      Volume: 95 Issue: 4 Pages: 043416-043416

    • DOI

      10.1103/physreva.95.043416

    • Related Report
      2016 Annual Research Report
    • Peer Reviewed / Acknowledgement Compliant
  • [Journal Article] High-harmonic generation enhanced by dynamical electron correlation2017

    • Author(s)
      Iliya Tikhomirov, Takeshi Sato, and Kenichi L. Ishikawa
    • Journal Title

      Phys. Rev. Lett.

      Volume: 118 Issue: 20

    • DOI

      10.1103/physrevlett.118.203202

    • Related Report
      2016 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Time-dependent complete-active-space self-consistent-field method for atoms: Application to high-harmonic generation2016

    • Author(s)
      T. Sato and K. L. Ishikawa
    • Journal Title

      Physical Review A

      Volume: 94 Issue: 2

    • DOI

      10.1103/physreva.94.023405

    • Related Report
      2016 Annual Research Report
    • Peer Reviewed / Int'l Joint Research / Acknowledgement Compliant
  • [Presentation] Time-dependent wave function-based methods for intense laser-driven multielectron dynamics in atoms and molecules2019

    • Author(s)
      Takeshi Sato
    • Organizer
      International Symposium on Ultrafast Electronic and Structural Dynamics
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Real-time simulations of electron dynamics in strong laser fields2018

    • Author(s)
      Kenichi L. Ishikawa
    • Organizer
      International Workshop on Frontiers in Lasers and Applications (FLA2018)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent optimized coupled-cluster method for intense laser-driven multielectron dynamics2018

    • Author(s)
      Takeshi Sato
    • Organizer
      7th JCS (Japan-Czech-Slovak) Symposium
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Coherent control with bichromatic extreme-ultraviolet free-electron-laser pulses2018

    • Author(s)
      Kenichi L. Ishikawa
    • Organizer
      The 9th Shanghai-Tokyo Advanced Research Symposium on Ultrafast Intense Laser Science (STAR9)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] First-principles simulation methods for multielectron dynamics in ultrashort intense laser fields2018

    • Author(s)
      Kenichi L. Ishikawa
    • Organizer
      International Conference on Electronic Spectroscopy and Structure (ICESS 2018)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Application of time-dependent multiconfiguration and coupled-cluster methods to intense-laser driven multielectron dynamics in atoms and molecules2018

    • Author(s)
      Takeshi Sato
    • Organizer
      The 9th Asian Workshop on Generation and Application of Coherent XUV and X-ray Radiation (9th AWCXR)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] 実時間第一原理計算で探る高強度レーザー場と原子・分子の相互作用2018

    • Author(s)
      石川顕一
    • Organizer
      日本コンピュータ化学会2018秋季年会
    • Related Report
      2018 Annual Research Report
    • Invited
  • [Presentation] Real Time Simulations of Electron Dynamics in Strong Lalser Fields2018

    • Author(s)
      Kenichi L. Ishikawa
    • Organizer
      The 10th International Conference on Photonics and Applications (ICPA-10)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent wavefunction-based methods for intense laser-driven multielectron dynamics2018

    • Author(s)
      Takeshi Sato
    • Organizer
      The International Symposium on Ab Initio Electron Dynamics Simulations (AIEDS18)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent multiconfiguration and coupled-cluster methods for intense-laser driven multielectron dynamics2018

    • Author(s)
      Takeshi Sato
    • Organizer
      Super-Intense Laser-Atom Physics international workshop (SILAP)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] 2色極端紫外レーザーによるHe及びNe原子の 光電子角度分布のコヒーレント制御2018

    • Author(s)
      トゥグス オユーンビレグ
    • Organizer
      第13回分子科学討論会
    • Related Report
      2018 Annual Research Report
  • [Presentation] 2色極端紫外レーザーによるHeおよびNe原子の光電子角度分布のコヒーレント制御2018

    • Author(s)
      トゥグス オユーンビレグ
    • Organizer
      2018年 第79回応用物理学会秋季学術講演会
    • Related Report
      2018 Annual Research Report
  • [Presentation] Coherent control of photoelectron angular distribution of He and Ne atoms by bichromatic extreme ultraviolet laser2018

    • Author(s)
      Oyunbileg Tugs
    • Organizer
      The 9th Asian Workshop on Generation and Application of Coherent XUV and X-ray Radiation (9th AWCXR)
    • Related Report
      2018 Annual Research Report
    • Int'l Joint Research
  • [Presentation] Theory on electron wave packet dynamics with ultrashort coherent extreme-ultraviolet pulses2018

    • Author(s)
      Kenichi Ishikawa
    • Organizer
      9th Ringberg workshop on Science with FELs
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time‐dependent coupled‐cluster method for laser‐driven multielectron dynamics2018

    • Author(s)
      Himadri Pathak
    • Organizer
      14TH INTERNATIONAL CONFERENCE OF COMPUTATIONAL METHODS IN SCIENCES AND ENGINEERING
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Coherent control and coherence control in photonization of Ne and He by bichromatic XUV pulses2017

    • Author(s)
      K.L.Ishikawa
    • Organizer
      Intense Fileld Short Wavelength Atomic and Molecular Processes (ISWAMP)
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Multielectron dynamics of atoms and molecules in strong laser fields2017

    • Author(s)
      Takeshi Sato
    • Organizer
      International Conference on Photonic Electronic and Atomic Collisions, International Conference on Photonic Electronic and Atomic Collisions (ICPEA)
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent Ab Initio Wavefunction Methods for Multielectron Dynamics of Atoms and Molecules in Intense Laser Fields2017

    • Author(s)
      Takeshi Sato
    • Organizer
      2nd International Symposium on Attosecond Science
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent ab initio wavefunction methods for multielectron dynamics of atoms and molecules in intense laser fields2017

    • Author(s)
      Takeshi Sato
    • Organizer
      物理化学コロキウム
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Simulation of high-order harmonic generation in solids2017

    • Author(s)
      K.L.Ishikawa
    • Organizer
      物理化学コロキウム
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent multiconfiguration self-consistent-field theory for electron dynamics in atoms and molecules2017

    • Author(s)
      K.L.Ishikawa
    • Organizer
      14th International Conference on Multiphoton Processes (ICOMP)
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Ab initio strong field physics2017

    • Author(s)
      Kenichi Ishikawa
    • Organizer
      International Symposium on Ultrafast Intense Laser Sciencef(ISUILS2017)
    • Related Report
      2017 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Development and applications of time-dependent ab initio wavefunction methods for intense-laser driven multielectron dynamics of atoms and molecules2017

    • Author(s)
      Takeshi Sato
    • Organizer
      3rd China-Japan-Korea Workshop on Theoretical and Computational Chemistry
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-dependent ab initio wavefunction methods for multielectron dynamics of atoms and molecules in intense laser fields2017

    • Author(s)
      Takeshi Sato
    • Organizer
      Okazaki conference: International Symposium on Ultrafast Dynamics in Molecular and Material Sciences
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Strong-field phenomena from the first principles2017

    • Author(s)
      Kenichi Ishikawa
    • Organizer
      The 8th Asian Workshop on Generationand Application of Coherent XUV and X-ray Radiation
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Implementation of the Time-Dependent Multiconfiguration Self-Consistent Field Methods for Atoms and Molecules in Intense Laser Fields2017

    • Author(s)
      K.L.Ishikawa
    • Organizer
      3rd Computational Chemistry Symposium
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Simulation of high-harmonic generation in solids, Shanghai-Tokyo Advanced Research Symposium on Ultrafast Intense Laser Science2017

    • Author(s)
      K.L.Ishikawa
    • Organizer
      Shanghai-Tokyo Advanced Research Symposium on Ultrafast Intense Laser Science
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] First-principles simulations of multielectron dynamics in intense laser field2016

    • Author(s)
      K.L.Ishikawa
    • Organizer
      The 7th Shanghai-Tokyo Advanced Research Symposium on Ultrafast Intense Laser Science
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Time-Dependent Multiconfiguration Self-Consistent-Field(TD-MCSCF) Approaches for Multielectron Dynamis in Intense Laser Fields2016

    • Author(s)
      K.L.Ishikawa
    • Organizer
      ITAMP Workshop
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Presentation] Strong-Fileld Phenomena from the First Principles2016

    • Author(s)
      K.L.Ishikawa
    • Organizer
      ASILS-9
    • Related Report
      2016 Annual Research Report
    • Int'l Joint Research / Invited
  • [Book] Progress in Ultrafast Intense Laser Science XIV2018

    • Author(s)
      Takeshi Sato, Yuki Orimo, Takuma Teramura, Oyunbileg Tugs, Kenichi L. Ishikawa
    • Total Pages
      29
    • Publisher
      Springer
    • ISBN
      9783030037864
    • Related Report
      2018 Annual Research Report
  • [Remarks] 東京大学大学院工学系研究科石川研究室

    • URL

      https://www.atto.t.u-tokyo.ac.jp

    • Related Report
      2018 Annual Research Report
  • [Remarks] 東京大学大学院工学系研究科石川研究室

    • URL

      http://www.atto.t.u-tokyo.ac.jp

    • Related Report
      2017 Annual Research Report 2016 Annual Research Report

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Published: 2016-04-21   Modified: 2020-03-30  

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