Double-ionization satellites in the x-ray emission spectrum of Ni metal

Valenza, Ryan A.; Jahrman, Evan P.; Kas, Joshua J.; Seidler, Gerald T.

doi:10.1103/physreva.96.032504

Double-ionization satellites in the x-ray emission spectrum of Ni metal

Journal Article · Tue Sep 05 00:00:00 EDT 2017 · Physical Review A

DOI:https://doi.org/10.1103/physreva.96.032504· OSTI ID:1535754

Valenza, Ryan A. ^[1]; Jahrman, Evan P. ^[2]; Kas, Joshua J. ^[2]; Seidler, Gerald T. ^[2]

Univ. of Washington, Seattle, WA (United States); DOE/OSTI
Univ. of Washington, Seattle, WA (United States)

We report measurements of the nonresonant x-ray emission spectroscopy (XES) from Ni metal in an energy range spanning the Kβ diagram line, valence-to-core emission, and double-ionization (DI) satellites that appear beyond the single-particle Fermi level. We make special use of a laboratory-based x-ray spectrometer capable of both x-ray emission and x-ray absorption measurements to accurately align the XES and x-ray absorption spectra to a common energy scale. The careful alignment of energy scales is requisite for correction of the strong sample absorption of DI fluorescence above the Ni K-edge energy. The successful correction of absorption effects allows a determination of the branching ratios for the [1s3d], [1s3p] , [1s2p] and [1s2s] satellites with respect to their corresponding diagram lines. We compare our results with other work, finding good agreement with prior experiments and with theoretical calculations in the multiconfiguration Dirac-Fock framework.

View Accepted Manuscript (DOE)

Research Organization:: Univ. of Washington, Seattle, WA (United States)

Sponsoring Organization:: USDOE Office of Science (SC); USDOE Office of Science (SC), Basic Energy Sciences (BES); USDOE Office of Science (SC), Fusion Energy Sciences (FES)

Grant/Contract Number:: FG02-97ER45623; SC0002194; SC0016251

OSTI ID:: 1535754

Alternate ID(s):: OSTI ID: 1378411

Journal Information:: Physical Review A, Journal Name: Physical Review A Journal Issue: 3 Vol. 96; ISSN PLRAAN; ISSN 2469-9926

Publisher:: American Physical Society (APS)Copyright Statement

Country of Publication:: United States

Language:: English

References (64)

Evolution of satellite lines Mukoyama, T.; Uda, M.; Kövér, L. X-Ray Spectrometry, Vol. 38, Issue 2 https://doi.org/10.1002/xrs.1143	journal	March 2009
Comparison of models for evolution of X-ray satellite lines Mukoyama, T.; Uda, M.; Kövér, L. X-Ray Spectrometry, Vol. 38, Issue 5 https://doi.org/10.1002/xrs.1194	journal	September 2009
Core hole satellites in Ni and Au Ni Bosch, A.; Feil, H.; Sawatzky, G. A. Solid State Communications, Vol. 41, Issue 4 https://doi.org/10.1016/0038-1098(82)90392-1	journal	January 1982
Is ionization adiabatic near threshold? Thomas, T. Darrah Journal of Electron Spectroscopy and Related Phenomena, Vol. 40, Issue 3 https://doi.org/10.1016/0368-2048(86)80024-X	journal	January 1986
X-ray satellite intensities in the sudden approximation Åberg, T. Physics Letters A, Vol. 26, Issue 10 https://doi.org/10.1016/0375-9601(68)90823-2	journal	April 1968
Multielectron effects in the XPS spectra of nickel Hüfner, S.; Wertheim, G. K. Physics Letters A, Vol. 51, Issue 5 https://doi.org/10.1016/0375-9601(75)90457-0	journal	March 1975
Some secondary phenomena in x-ray spectra Richtmyer, F. K. Journal of the Franklin Institute, Vol. 208, Issue 3 https://doi.org/10.1016/S0016-0032(29)91177-7	journal	September 1929
New type of auger effect and its influence on the x-ray spectrum Coster, D.; L. Kronig, R. De Physica, Vol. 2, Issue 1-12 https://doi.org/10.1016/S0031-8914(35)90060-X	journal	January 1935
Robust optic alignment in a tilt-free implementation of the Rowland circle spectrometer Mortensen, Devon R.; Seidler, Gerald T. Journal of Electron Spectroscopy and Related Phenomena, Vol. 215 https://doi.org/10.1016/j.elspec.2016.11.006	journal	February 2017
A new approach to relativistic multi-configuration quantum mechanics in titanium Lowe, J. A.; Chantler, C. T.; Grant, I. P. Physics Letters A, Vol. 374, Issue 47 https://doi.org/10.1016/j.physleta.2010.09.055	journal	October 2010
Contribution of the [1s3d] shake process to Kα1,2 spectra in 3d elements Ito, Y.; Tochio, T.; Oohashi, H. Radiation Physics and Chemistry, Vol. 75, Issue 11 https://doi.org/10.1016/j.radphyschem.2005.10.023	journal	November 2006
Shake up and shake off probabilities for L-, M-, and N-electrons in atoms with Z=3 to 60 Kochur, Andrei G.; Popov, Vitali A. Radiation Physics and Chemistry, Vol. 75, Issue 11 https://doi.org/10.1016/j.radphyschem.2005.11.007	journal	November 2006
The evolution of inner-shell multielectronic X-ray spectra from threshold to saturation for low- to high-Z atoms Diamant, R.; Huotari, S.; Hämäläinen, K. Radiation Physics and Chemistry, Vol. 75, Issue 11 https://doi.org/10.1016/j.radphyschem.2006.05.002	journal	November 2006
New interpretations of XPS spectra of nickel metal and oxides Grosvenor, Andrew P.; Biesinger, Mark C.; Smart, Roger St. C. Surface Science, Vol. 600, Issue 9 https://doi.org/10.1016/j.susc.2006.01.041	journal	May 2006
A laboratory-based hard x-ray monochromator for high-resolution x-ray emission spectroscopy and x-ray absorption near edge structure measurements Seidler, G. T.; Mortensen, D. R.; Remesnik, A. J. Review of Scientific Instruments, Vol. 85, Issue 11 https://doi.org/10.1063/1.4901599	journal	November 2014
Errors Associated with Fitting Gaussian Profiles to Noisy Emission-Line Spectra Lenz, Dawn D.; Ayres, Thomas R. Publications of the Astronomical Society of the Pacific, Vol. 104 https://doi.org/10.1086/133096	journal	May 1992
Many-electron singularity in X-ray photoemission and X-ray line spectra from metals Doniach, S.; Sunjic, M. Journal of Physics C: Solid State Physics, Vol. 3, Issue 2 https://doi.org/10.1088/0022-3719/3/2/010	journal	February 1970
On the Identification of the K Satellites - I: LS Region Horák, Z. Proceedings of the Physical Society, Vol. 77, Issue 5 https://doi.org/10.1088/0370-1328/77/5/305	journal	May 1961
On the role of shake-off in single-photon double ionization Pattard, T.; Schneider, T.; Rost, J. M. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 36, Issue 12 https://doi.org/10.1088/0953-4075/36/12/101	journal	May 2003
Evolution of the K x-ray satellites for Fe, Ni and Zn: from threshold to saturation Kawatsura, K.; Morikawa, T.; Takahiro, K. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 36, Issue 20 https://doi.org/10.1088/0953-4075/36/20/001	journal	October 2003
Probabilities of multiple shake processes in sudden approximation Kochur, A. G.; Popov, V. A. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 39, Issue 16 https://doi.org/10.1088/0953-4075/39/16/016	journal	August 2006
First measurement of Lyman alpha x-ray lines in hydrogen-like vanadium: results and implications for precision wavelength metrology and tests of QED Gillaspy, J. D.; Chantler, C. T.; Paterson, D. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 43, Issue 7 https://doi.org/10.1088/0953-4075/43/7/074021	journal	March 2010
High-accuracy reconstruction of titanium x-ray emission spectra, including relative intensities, asymmetry and satellites, and ab initio determination of shake magnitudes for transition metals Chantler, C. T.; Lowe, J. A.; Grant, I. P. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 46, Issue 1 https://doi.org/10.1088/0953-4075/46/1/015002	journal	December 2012
A Modern Laboratory XAFS Cookbook Seidler, Gt; Mortensen, Dr; Ditter, As Journal of Physics: Conference Series, Vol. 712 https://doi.org/10.1088/1742-6596/712/1/012015	journal	May 2016
Benchtop Nonresonant X-ray Emission Spectroscopy: Coming Soon to Laboratories and XAS Beamlines Near You? Mortensen, Devon R.; Seidler, Gerald T.; Ditter, Alexander S. Journal of Physics: Conference Series, Vol. 712 https://doi.org/10.1088/1742-6596/712/1/012036	journal	May 2016
Calculation of Electron Shake-Off for Elements from Z = 2 to 92 with the Use of Self-Consistent-Field Wave Functions Carlson, Thomas A.; Nestor, C. W.; Tucker, Thomas C. Physical Review, Vol. 169, Issue 1 https://doi.org/10.1103/PhysRev.169.27	journal	May 1968
The Satellites of the X-Ray Lines L α , L β 1 and L β 2 Richtmyer, F. K.; Richtmyer, R. D. Physical Review, Vol. 34, Issue 4 https://doi.org/10.1103/PhysRev.34.574	journal	August 1929
Correlation effects in double- K -vacancy production Briand, J. P.; Chevallier, P.; Chetioui, A. Physical Review A, Vol. 23, Issue 1 https://doi.org/10.1103/PhysRevA.23.39	journal	January 1981
Atomic excitation as the result of inner-shell vacancy production Mukoyama, Takeshi; Taniguchi, Kazuo Physical Review A, Vol. 36, Issue 2 https://doi.org/10.1103/PhysRevA.36.693	journal	July 1987
Energy dependence of the electron shakeup and shakeoff: Evidence of different levels of nonseparability Vatai, E. Physical Review A, Vol. 38, Issue 7 https://doi.org/10.1103/PhysRevA.38.3777	journal	October 1988
Multielectron inner-shell photoexcitation in absorption spectra of Kr: Theory and experiment Schaphorst, Stephen J.; Kodre, Alojz F.; Ruscheinski, Johannes Physical Review A, Vol. 47, Issue 3 https://doi.org/10.1103/PhysRevA.47.1953	journal	March 1993
Double photoionization of excited 1 S and 3 S states of the helium isoelectronic sequence Forrey, R. C.; Sadeghpour, H. R.; Baker, J. D. Physical Review A, Vol. 51, Issue 3 https://doi.org/10.1103/PhysRevA.51.2112	journal	March 1995
K α and K β x-ray emission spectra of copper Deutsch, M.; Hölzer, G.; Härtwig, J. Physical Review A, Vol. 51, Issue 1 https://doi.org/10.1103/PhysRevA.51.283	journal	January 1995
Atomic background in x-ray absorption spectra of fifth-period elements: Evidence for double-electron excitation edges Filipponi, Adriano; Di Cicco, Andrea Physical Review A, Vol. 52, Issue 2 https://doi.org/10.1103/PhysRevA.52.1072	journal	August 1995
K α 1 , 2 and K β 1 , 3 x-ray emission lines of the 3 d transition metals Hölzer, G.; Fritsch, M.; Deutsch, M. Physical Review A, Vol. 56, Issue 6 https://doi.org/10.1103/PhysRevA.56.4554	journal	December 1997
K α and K β x-ray emission spectra of metallic scandium Anagnostopoulos, Dimitrios F.; Sharon, Ruth; Gotta, Detlev Physical Review A, Vol. 60, Issue 3 https://doi.org/10.1103/PhysRevA.60.2018	journal	September 1999
Evolution of the germanium K β ′ ′ ′ x-ray satellites from threshold to saturation Sternemann, C.; Kaprolat, A.; Krisch, M. H. Physical Review A, Vol. 61, Issue 2 https://doi.org/10.1103/PhysRevA.61.020501	journal	January 2000
α dependence of transition frequencies for ions Si II, Cr II, Fe II, Ni II, and Zn II Dzuba, V. A.; Flambaum, V. V.; Kozlov, M. G. Physical Review A, Vol. 66, Issue 2 https://doi.org/10.1103/PhysRevA.66.022501	journal	August 2002
Near-threshold multielectronic effects in the Cu K α 1 , 2 x-ray spectrum Galambosi, S.; Sutinen, H.; Mattila, A. Physical Review A, Vol. 67, Issue 2 https://doi.org/10.1103/PhysRevA.67.022510	journal	February 2003
3 d spectator hole satellites of the Cu K β 1 , 3 and K β 2 , 5 emission spectrum Enkisch, H.; Sternemann, C.; Paulus, M. Physical Review A, Vol. 70, Issue 2 https://doi.org/10.1103/PhysRevA.70.022508	journal	August 2004
Characterization of K α spectral profiles for vanadium, component redetermination for scandium, titanium, chromium, and manganese, and development of satellite structure for Z = 21 to Z = 25 Chantler, C. T.; Kinnane, M. N.; Su, C. -H. Physical Review A, Vol. 73, Issue 1 https://doi.org/10.1103/PhysRevA.73.012508	journal	January 2006
Hydrogenic Lamb shift in Ge 31 + and the fine-structure Lamb shift Chantler, C. T.; Laming, J. M.; Silver, J. D. Physical Review A, Vol. 80, Issue 2 https://doi.org/10.1103/PhysRevA.80.022508	journal	August 2009
Multiconfiguration Dirac-Fock calculations in open-shell atoms: Convergence methods and satellite spectra of the copper K α photoemission spectrum Chantler, C. T.; Lowe, J. A.; Grant, I. P. Physical Review A, Vol. 82, Issue 5 https://doi.org/10.1103/PhysRevA.82.052505	journal	November 2010
Double K -shell photoionization and hypersatellite x-ray transitions of 12 ⩽ Z ⩽ 23 atoms Hoszowska, J.; Dousse, J. -Cl.; Cao, W. Physical Review A, Vol. 82, Issue 6 https://doi.org/10.1103/PhysRevA.82.063408	journal	December 2010
Ab initio determination of satellite intensities in transition-metal photoemission spectroscopy using a multiconfiguration framework Lowe, J. A.; Chantler, C. T.; Grant, I. P. Physical Review A, Vol. 83, Issue 6 https://doi.org/10.1103/PhysRevA.83.060501	journal	June 2011
High-resolution x-ray-emission study of 1 s 4 p and 1 s 3 d two-electron photoexcitations in Kr Kavčič, M.; Žitnik, M.; Sokaras, D. Physical Review A, Vol. 90, Issue 2 https://doi.org/10.1103/PhysRevA.90.022513	journal	August 2014
Validity of the (Z+1) ion-core approximation for deep and shallow levels as studied by the extended energy-loss fine-structure technique Chanet, E.; De Crescenzi, M.; Derrien, J. Physical Review B, Vol. 31, Issue 11 https://doi.org/10.1103/PhysRevB.31.7469	journal	June 1985
Influence of double-electron transitions on the EXAFS L edges of rare-earth systems Chaboy, Jesús; Marcelli, Augusto; Tyson, Trevor A. Physical Review B, Vol. 49, Issue 17 https://doi.org/10.1103/PhysRevB.49.11652	journal	May 1994
High-Resolution X-Ray Photoemission Spectrum of the Valence Bands of Gold Shirley, D. A. Physical Review B, Vol. 5, Issue 12 https://doi.org/10.1103/PhysRevB.5.4709	journal	June 1972
High-kinetic-energy photoemission spectroscopy of Ni at 1 s : 6-eV satellite at 4 eV Karis, O.; Svensson, S.; Rusz, J. Physical Review B, Vol. 78, Issue 23 https://doi.org/10.1103/PhysRevB.78.233105	journal	December 2008
Transition probability calculations for atoms using nonorthogonal orbitals Olsen, Jeppe; Godefroid, Michel R.; Jönsson, Per Physical Review E, Vol. 52, Issue 4 https://doi.org/10.1103/PhysRevE.52.4499	journal	October 1995
Physical Mechanisms and Scaling Laws of K -Shell Double Photoionization Hoszowska, J.; Kheifets, A. K.; Dousse, J. -Cl. Physical Review Letters, Vol. 102, Issue 7 https://doi.org/10.1103/PhysRevLett.102.073006	journal	February 2009
Effect of Self-Energy Corrections on the Valence-Band Photoemission Spectra of Ni Liebsch, Ansgar Physical Review Letters, Vol. 43, Issue 19 https://doi.org/10.1103/PhysRevLett.43.1431	journal	November 1979
Valence-Band and Core-Level Satellites in Nickel and Related Elements Mårtensson, Nils; Johansson, Börje Physical Review Letters, Vol. 45, Issue 6 https://doi.org/10.1103/PhysRevLett.45.482	journal	August 1980
Transition from Adiabatic to Sudden Excitation of Core Electrons Thomas, T. Darrah Physical Review Letters, Vol. 52, Issue 6 https://doi.org/10.1103/PhysRevLett.52.417	journal	February 1984
Multielectron X-Ray Photoexcitation Measurements in Krypton Deutsch, Moshe; Hart, Michael Physical Review Letters, Vol. 57, Issue 13 https://doi.org/10.1103/PhysRevLett.57.1566	journal	September 1986
Multiplet structure in Ni K β x-ray fluorescence spectra of nickel compounds Kawai, Jun; Takami, Michio; Satoko, Chikatoshi Physical Review Letters, Vol. 65, Issue 17 https://doi.org/10.1103/PhysRevLett.65.2193	journal	October 1990
Multielectron x-ray photoexcitation observations in x-ray-absorption fine-structure background Li, Guoguang; Bridges, Frank; Brown, George S. Physical Review Letters, Vol. 68, Issue 10 https://doi.org/10.1103/PhysRevLett.68.1609	journal	March 1992
Multiple-electron excitation in X-ray absorption: a simple generic model Roy, M.; Lindsay, J. D.; Louch, S. Journal of Synchrotron Radiation, Vol. 8, Issue 4 https://doi.org/10.1107/S0909049501008160	journal	June 2001
ATHENA , ARTEMIS , HEPHAESTUS : data analysis for X-ray absorption spectroscopy using IFEFFIT Ravel, B.; Newville, M. Journal of Synchrotron Radiation, Vol. 12, Issue 4 https://doi.org/10.1107/S0909049505012719	journal	June 2005
Development and exploration of a new methodology for the fitting and analysis of XAS data Delgado-Jaime, Mario Ulises; Kennepohl, Pierre Journal of Synchrotron Radiation, Vol. 17, Issue 1 https://doi.org/10.1107/S090904950904655X	journal	December 2009
Blueprint XAS : a Matlab -based toolbox for the fitting and analysis of XAS spectra Delgado-Jaime, Mario Ulises; Mewis, Craig Philip; Kennepohl, Pierre Journal of Synchrotron Radiation, Vol. 17, Issue 1 https://doi.org/10.1107/S0909049509046561	journal	December 2009
A tool to plan photon-in/photon-out experiments: count rates, dips and self-absorption Bianchini, Matteo; Glatzel, Pieter Journal of Synchrotron Radiation, Vol. 19, Issue 6 https://doi.org/10.1107/S0909049512038551	journal	October 2012
Interpretation of Magnetic Circular Dichroism of X-ray Emission Spectra Takayama, Yasuhiro; Yoshida, Tetsuo; Nakamura, Satoshi Journal of the Physical Society of Japan, Vol. 75, Issue 12 https://doi.org/10.1143/JPSJ.75.124709	journal	December 2006

Cited By (5)

An improved laboratory-based x-ray absorption fine structure and x-ray emission spectrometer for analytical applications in materials chemistry research Jahrman, Evan P.; Holden, William M.; Ditter, Alexander S. Review of Scientific Instruments, Vol. 90, Issue 2 https://doi.org/10.1063/1.5049383	journal	February 2019
Vacuum formed temporary spherically and toroidally bent crystal analyzers for x-ray absorption and x-ray emission spectroscopy Jahrman, Evan P.; Holden, William M.; Ditter, Alexander S. Review of Scientific Instruments, Vol. 90, Issue 1 https://doi.org/10.1063/1.5057231	journal	January 2019
In-house setup for laboratory-based x-ray absorption fine structure spectroscopy measurements Zeeshan, F.; Hoszowska, J.; Loperetti-Tornay, L. Review of Scientific Instruments, Vol. 90, Issue 7 https://doi.org/10.1063/1.5094873	journal	July 2019
Benchmark results and theoretical treatments for valence-to-core x-ray emission spectroscopy in transition metal compounds Mortensen, D. R.; Seidler, G. T.; Kas, Joshua J. Physical Review B, Vol. 96, Issue 12 https://doi.org/10.1103/physrevb.96.125136	journal	September 2017
Benchmark Results and Theoretical Treatments for Valence-to-Core X-ray Emission Spectroscopy in Transition Metal Compounds Mortensen, D. R.; Seidler, G. T.; Kas, J. J. arXiv https://doi.org/10.48550/arxiv.1706.09054	text	January 2017

Similar Records

3d spectator hole satellites of the Cu K{beta}{sub 1,3} and K{beta}{sub 2,5} emission spectrum

Journal Article · Sun Aug 01 00:00:00 EDT 2004 · Physical Review. A · OSTI ID:20645883

Dielectric satellite spectra of Li-like ions

Journal Article · Sat Oct 31 23:00:00 EST 1987 · At. Data Nucl. Data Tables; (United States) · OSTI ID:5596031

Separation of Two-Electron Photoexcited Atomic Processes near the Inner-Shell Threshold

Journal Article · Fri Apr 10 00:00:00 EDT 2009 · Physical Review Letters · OSTI ID:21180356

Related Subjects

74 ATOMIC AND MOLECULAR PHYSICS
Atomic spectra
Electronic transitions
Optics
Physics

Double-ionization satellites in the x-ray emission spectrum of Ni metal

Citation Formats

References (64)

Cited By (5)

Similar Records

Related Subjects