DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information

Title: Femtosecond electronic structure response to high intensity XFEL pulses probed by iron X-ray emission spectroscopy

Abstract

We report the time-resolved femtosecond evolution of the K-shell X-ray emission spectra of iron during high intensity illumination of X-rays in a micron-sized focused hard X-ray free electron laser (XFEL) beam. Detailed pulse length dependent measurements revealed that rapid spectral energy shift and broadening started within the first 10 fs of the X-ray illumination at intensity levels between 1017 and 1018 W cm-2. We attribute these spectral changes to the rapid evolution of high-density photoelectron mediated secondary collisional ionization processes upon the absorption of the incident XFEL radiation. These fast electronic processes, occurring at timescales well within the typical XFEL pulse durations (i.e., tens of fs), set the boundary conditions of the pulse intensity and sample parameters where the widely-accepted ‘probe-before-destroy’ measurement strategy can be adopted for electronic-structure related XFEL experiments.

Authors:
 [1];  [1];  [2];  [1];  [1];  [1];  [1];  [1];  [1];  [3];  [1];  [1];  [4];  [4];  [5];  [1];  [6];  [7];  [1];  [1] more »;  [1] « less
  1. SLAC National Accelerator Laboratory (SLAC), Menlo Park, CA (United States)
  2. Univ. Rennes (France)
  3. Paul Scherrer Institute (PSI), Villigen (Switzerland)
  4. Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)
  5. European XFEL, Schenefeld (Germany)
  6. ShanghaiTech University (China)
  7. Beijing Normal University (China)
Publication Date:
Research Org.:
SLAC National Accelerator Laboratory (SLAC), Menlo Park, CA (United States)
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES). Scientific User Facilities Division
Contributing Org.:
SLAC National Accelerator Laboratory, Menlo Park, CA-94025, USA. Univ Rennes, CNRS, IPR (Institut de Physique de Rennes) - UMR 6251, F-35000 Rennes. France. SwissFEL, Paul Scherrer Institute, 5232 Villigen, Switzerland Deutsches Elektronen-Synchrotron DESY, Notkestraße 85, 22607 Hamburg, Germany. European XFEL, Holzkoppel 4, 22869 Schenefeld, Germany High Pressure for Science & Technology Advanced Research, Shanghai 201203, China Department of Physics and Applied Optics Beijing Area Major Laboratory, Center for Advanced Quantum Studies, Beijing Normal University, Beijing 100875, China
OSTI Identifier:
1671331
Alternate Identifier(s):
OSTI ID: 1769046
Grant/Contract Number:  
AC02-76SF00515
Resource Type:
Accepted Manuscript
Journal Name:
Scientific Reports
Additional Journal Information:
Journal Volume: 10; Journal Issue: 1; Journal ID: ISSN 2045-2322
Publisher:
Nature Publishing Group
Country of Publication:
United States
Language:
English
Subject:
99 GENERAL AND MISCELLANEOUS; XES; XFEL

Citation Formats

Alonso-Mori, Roberto, Sokaras, Dimosthenis, Cammarata, Marco, Ding, Yuantao, Feng, Yiping, Fritz, David, Gaffney, Kelly J., Hastings, Jerome, Kao, Chi-Chang, Lemke, Henrik T., Maxwell, Timothy, Robert, Aymeric, Schropp, Andreas, Seiboth, Frank, Sikorski, Marcin, Song, Sanghoon, Weng, Tsu-Chien, Zhang, Wenkai, Glenzer, Siegfried, Bergmann, Uwe, and Zhu, Diling. Femtosecond electronic structure response to high intensity XFEL pulses probed by iron X-ray emission spectroscopy. United States: N. p., 2020. Web. doi:10.1038/s41598-020-74003-1.
Alonso-Mori, Roberto, Sokaras, Dimosthenis, Cammarata, Marco, Ding, Yuantao, Feng, Yiping, Fritz, David, Gaffney, Kelly J., Hastings, Jerome, Kao, Chi-Chang, Lemke, Henrik T., Maxwell, Timothy, Robert, Aymeric, Schropp, Andreas, Seiboth, Frank, Sikorski, Marcin, Song, Sanghoon, Weng, Tsu-Chien, Zhang, Wenkai, Glenzer, Siegfried, Bergmann, Uwe, & Zhu, Diling. Femtosecond electronic structure response to high intensity XFEL pulses probed by iron X-ray emission spectroscopy. United States. https://doi.org/10.1038/s41598-020-74003-1
Alonso-Mori, Roberto, Sokaras, Dimosthenis, Cammarata, Marco, Ding, Yuantao, Feng, Yiping, Fritz, David, Gaffney, Kelly J., Hastings, Jerome, Kao, Chi-Chang, Lemke, Henrik T., Maxwell, Timothy, Robert, Aymeric, Schropp, Andreas, Seiboth, Frank, Sikorski, Marcin, Song, Sanghoon, Weng, Tsu-Chien, Zhang, Wenkai, Glenzer, Siegfried, Bergmann, Uwe, and Zhu, Diling. Thu . "Femtosecond electronic structure response to high intensity XFEL pulses probed by iron X-ray emission spectroscopy". United States. https://doi.org/10.1038/s41598-020-74003-1. https://www.osti.gov/servlets/purl/1671331.
@article{osti_1671331,
title = {Femtosecond electronic structure response to high intensity XFEL pulses probed by iron X-ray emission spectroscopy},
author = {Alonso-Mori, Roberto and Sokaras, Dimosthenis and Cammarata, Marco and Ding, Yuantao and Feng, Yiping and Fritz, David and Gaffney, Kelly J. and Hastings, Jerome and Kao, Chi-Chang and Lemke, Henrik T. and Maxwell, Timothy and Robert, Aymeric and Schropp, Andreas and Seiboth, Frank and Sikorski, Marcin and Song, Sanghoon and Weng, Tsu-Chien and Zhang, Wenkai and Glenzer, Siegfried and Bergmann, Uwe and Zhu, Diling},
abstractNote = {We report the time-resolved femtosecond evolution of the K-shell X-ray emission spectra of iron during high intensity illumination of X-rays in a micron-sized focused hard X-ray free electron laser (XFEL) beam. Detailed pulse length dependent measurements revealed that rapid spectral energy shift and broadening started within the first 10 fs of the X-ray illumination at intensity levels between 1017 and 1018 W cm-2. We attribute these spectral changes to the rapid evolution of high-density photoelectron mediated secondary collisional ionization processes upon the absorption of the incident XFEL radiation. These fast electronic processes, occurring at timescales well within the typical XFEL pulse durations (i.e., tens of fs), set the boundary conditions of the pulse intensity and sample parameters where the widely-accepted ‘probe-before-destroy’ measurement strategy can be adopted for electronic-structure related XFEL experiments.},
doi = {10.1038/s41598-020-74003-1},
journal = {Scientific Reports},
number = 1,
volume = 10,
place = {United States},
year = {Thu Oct 08 00:00:00 EDT 2020},
month = {Thu Oct 08 00:00:00 EDT 2020}
}

Journal Article:
Free Publicly Available Full Text
Publisher's Version of Record

Figures / Tables:

Figure 1 Figure 1: Fe emission spectra (a) Kα, (b) Kβ1,3, and (c) Kβ2,5 measured with 10 fs X-ray pulses at different intensity levels up to ~ 9 × 1017 W cm− 2. All spectra are normalized to the shot-to-shot measurement of the incoming pulse energy.

Save / Share:

Works referenced in this record:

Single mimivirus particles intercepted and imaged with an X-ray laser
journal, February 2011

  • Seibert, M. Marvin; Ekeberg, Tomas; Maia, Filipe R. N. C.
  • Nature, Vol. 470, Issue 7332
  • DOI: 10.1038/nature09748

Multiplet effects in X-ray spectroscopy
journal, January 2005


Femtosecond x-ray pulse temporal characterization in free-electron lasers using a transverse deflector
journal, December 2011


Room temperature femtosecond X-ray diffraction of photosystem II microcrystals
journal, June 2012

  • Kern, J.; Alonso-Mori, R.; Hellmich, J.
  • Proceedings of the National Academy of Sciences, Vol. 109, Issue 25, p. 9721-9726
  • DOI: 10.1073/pnas.1204598109

Imaging single cells in a beam of live cyanobacteria with an X-ray laser
journal, February 2015

  • van der Schot, Gijs; Svenda, Martin; Maia, Filipe R. N. C.
  • Nature Communications, Vol. 6, Issue 1
  • DOI: 10.1038/ncomms6704

Tracking excited-state charge and spin dynamics in iron coordination complexes
journal, May 2014

  • Zhang, Wenkai; Alonso-Mori, Roberto; Bergmann, Uwe
  • Nature, Vol. 509, Issue 7500
  • DOI: 10.1038/nature13252

High-Resolution Protein Structure Determination by Serial Femtosecond Crystallography
journal, May 2012


A multi-crystal wavelength dispersive x-ray spectrometer
journal, July 2012

  • Alonso-Mori, Roberto; Kern, Jan; Sokaras, Dimosthenis
  • Review of Scientific Instruments, Vol. 83, Issue 7
  • DOI: 10.1063/1.4737630

Femtosecond X-ray protein nanocrystallography
journal, February 2011

  • Chapman, Henry N.; Fromme, Petra; Barty, Anton
  • Nature, Vol. 470, Issue 7332, p. 73-77
  • DOI: 10.1038/nature09750

Metalloprotein entatic control of ligand-metal bonds quantified by ultrafast x-ray spectroscopy
journal, June 2017


Impact of hollow-atom formation on coherent x-ray scattering at high intensity
journal, March 2011


High resolution 1s core hole X-ray spectroscopy in 3d transition metal complexes—electronic and structural information
journal, January 2005


Taking snapshots of photosynthetic water oxidation using femtosecond X-ray diffraction and spectroscopy
journal, July 2014

  • Kern, Jan; Tran, Rosalie; Alonso-Mori, Roberto
  • Nature Communications, Vol. 5, Issue 1
  • DOI: 10.1038/ncomms5371

Femtosecond X-Ray Pulse Characterization in Free-Electron Lasers Using a Cross-Correlation Technique
journal, December 2012


Indications of radiation damage in ferredoxin microcrystals using high-intensity X-FEL beams
journal, February 2015

  • Nass, Karol; Foucar, Lutz; Barends, Thomas R. M.
  • Journal of Synchrotron Radiation, Vol. 22, Issue 2
  • DOI: 10.1107/S1600577515002349

A hard x-ray transmissive single-shot spectrometer for FEL sources
conference, October 2012

  • Feng, Yiping; Zhu, Diling; Feldkamp, Jan M.
  • SPIE Optical Engineering + Applications, SPIE Proceedings
  • DOI: 10.1117/12.930943

Full spatial characterization of a nanofocused x-ray free-electron laser beam by ptychographic imaging
journal, April 2013

  • Schropp, Andreas; Hoppe, Robert; Meier, Vivienne
  • Scientific Reports, Vol. 3, Issue 1
  • DOI: 10.1038/srep01633

Simultaneous Femtosecond X-ray Spectroscopy and Diffraction of Photosystem II at Room Temperature
journal, February 2013


The X-ray Pump–Probe instrument at the Linac Coherent Light Source
journal, April 2015

  • Chollet, Matthieu; Alonso-Mori, Roberto; Cammarata, Marco
  • Journal of Synchrotron Radiation, Vol. 22, Issue 3
  • DOI: 10.1107/S1600577515005135

X-ray Emission Spectroscopy at X-ray Free Electron Lasers: Limits to Observation of the Classical Spectroscopic Response for Electronic Structure Analysis
journal, December 2018

  • Jensen, Scott C.; Sullivan, Brendan; Hartzler, Daniel A.
  • The Journal of Physical Chemistry Letters, Vol. 10, Issue 3
  • DOI: 10.1021/acs.jpclett.8b03595

Potential for biomolecular imaging with femtosecond X-ray pulses
journal, August 2000

  • Neutze, Richard; Wouts, Remco; van der Spoel, David
  • Nature, Vol. 406, Issue 6797
  • DOI: 10.1038/35021099

Energy-dispersive X-ray emission spectroscopy using an X-ray free-electron laser in a shot-by-shot mode
journal, November 2012

  • Alonso-Mori, R.; Kern, J.; Gildea, R. J.
  • Proceedings of the National Academy of Sciences, Vol. 109, Issue 47, p. 19103-19107
  • DOI: 10.1073/pnas.1211384109

Inception of electronic damage of matter by photon-driven post-ionization mechanisms
journal, March 2019

  • Błachucki, W.; Kayser, Y.; Czapla-Masztafiak, J.
  • Structural Dynamics, Vol. 6, Issue 2
  • DOI: 10.1063/1.5090332

Femtosecond diffractive imaging of biological cells
journal, September 2010

  • Marvin Seibert, M.; Boutet, Sébastien; Svenda, Martin
  • Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 43, Issue 19
  • DOI: 10.1088/0953-4075/43/19/194015

Tracking excited-state charge and spin dynamics in iron coordination complexes
journal, May 2014

  • Zhang, Wenkai; Alonso-Mori, Roberto; Bergmann, Uwe
  • Nature, Vol. 509, Issue 7500
  • DOI: 10.1038/nature13252

Full spatial characterization of a nanofocused x-ray free-electron laser beam by ptychographic imaging
journal, April 2013

  • Schropp, Andreas; Hoppe, Robert; Meier, Vivienne
  • Scientific Reports, Vol. 3, Issue 1
  • DOI: 10.1038/srep01633

Inception of electronic damage of matter by photon-driven post-ionization mechanisms
journal, March 2019

  • Błachucki, W.; Kayser, Y.; Czapla-Masztafiak, J.
  • Structural Dynamics, Vol. 6, Issue 2
  • DOI: 10.1063/1.5090332

Observation of K Hypersatellites and KL Satellites in the X-Ray Spectrum of Doubly K -Ionized Gallium
journal, September 1971


Focus characterization at an X-ray free-electron laser by coherent scattering and speckle analysis
journal, April 2015

  • Sikorski, Marcin; Song, Sanghoon; Schropp, Andreas
  • Journal of Synchrotron Radiation, Vol. 22, Issue 3
  • DOI: 10.1107/s1600577515004361

Photon-in photon-out hard X-ray spectroscopy at the Linac Coherent Light Source
journal, April 2015

  • Alonso-Mori, Roberto; Sokaras, Dimosthenis; Zhu, Diling
  • Journal of Synchrotron Radiation, Vol. 22, Issue 3
  • DOI: 10.1107/s1600577515004488

Works referencing / citing this record:

Probing Transient Valence Orbital Changes with Picosecond Valence-to-Core X-ray Emission Spectroscopy
journal, January 2017

  • March, Anne Marie; Assefa, Tadesse A.; Boemer, Christina
  • The Journal of Physical Chemistry C, Vol. 121, Issue 5
  • DOI: 10.1021/acs.jpcc.6b12940

Vibrational wavepacket dynamics in Fe carbene photosensitizer determined with femtosecond X-ray emission and scattering
journal, January 2020

  • Kunnus, Kristjan; Vacher, Morgane; Harlang, Tobias C. B.
  • Nature Communications, Vol. 11, Issue 1
  • DOI: 10.1038/s41467-020-14468-w

A versatile experimental system for tracking ultrafast chemical reactions with X-ray free-electron lasers
journal, September 2019

  • Katayama, Tetsuo; Nozawa, Shunsuke; Umena, Yasufumi
  • Structural Dynamics, Vol. 6, Issue 5
  • DOI: 10.1063/1.5111795

Communication: The electronic structure of matter probed with a single femtosecond hard x-ray pulse
text, January 2014


Figures/Tables have been extracted from DOE-funded journal article accepted manuscripts.