Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS

Herein we show that nonresonant inelastic x-ray scattering involving an s core level is a powerful spectroscopic method to characterize the excited states of transition metal compounds. The spherical charge distribution of the s core hole allows the orientational dependence of the intensities of the...

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Autores principales: A. Amorese, B. Leedahl, M. Sundermann, H. Gretarsson, Z. Hu, H.-J. Lin, C. T. Chen, M. Schmidt, H. Borrmann, Yu. Grin, A. Severing, M. W. Haverkort, L. H. Tjeng
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Publicado: American Physical Society 2021
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spelling oai:doaj.org-article:8119911786f34b4d8523ba51bc156e652021-12-02T14:09:11ZSelective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS10.1103/PhysRevX.11.0110022160-3308https://doaj.org/article/8119911786f34b4d8523ba51bc156e652021-01-01T00:00:00Zhttp://doi.org/10.1103/PhysRevX.11.011002http://doi.org/10.1103/PhysRevX.11.011002https://doaj.org/toc/2160-3308Herein we show that nonresonant inelastic x-ray scattering involving an s core level is a powerful spectroscopic method to characterize the excited states of transition metal compounds. The spherical charge distribution of the s core hole allows the orientational dependence of the intensities of the various spectral features to produce a spatial charge image of the associated multiplet states in a straightforward manner, thereby facilitating the identification of their orbital character. In addition, the s core hole does not add an extra orbital angular momentum component to the multiplet structure so that the well-established Sugano-Tanabe-Kamimura diagrams can be used for the analysis of the spectra. For α-MnS we observe the spherical charge density corresponding to its high-spin 3d^{5} (^{6}A_{1}) ground state configuration and we were able to selectively image its excited states and identify them as t_{2g} (^{5}T_{2}) and e_{g} (^{5}E) with an energy splitting 10Dq of 0.78 eV.A. AmoreseB. LeedahlM. SundermannH. GretarssonZ. HuH.-J. LinC. T. ChenM. SchmidtH. BorrmannYu. GrinA. SeveringM. W. HaverkortL. H. TjengAmerican Physical SocietyarticlePhysicsQC1-999ENPhysical Review X, Vol 11, Iss 1, p 011002 (2021)
institution DOAJ
collection DOAJ
language EN
topic Physics
QC1-999
spellingShingle Physics
QC1-999
A. Amorese
B. Leedahl
M. Sundermann
H. Gretarsson
Z. Hu
H.-J. Lin
C. T. Chen
M. Schmidt
H. Borrmann
Yu. Grin
A. Severing
M. W. Haverkort
L. H. Tjeng
Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS
description Herein we show that nonresonant inelastic x-ray scattering involving an s core level is a powerful spectroscopic method to characterize the excited states of transition metal compounds. The spherical charge distribution of the s core hole allows the orientational dependence of the intensities of the various spectral features to produce a spatial charge image of the associated multiplet states in a straightforward manner, thereby facilitating the identification of their orbital character. In addition, the s core hole does not add an extra orbital angular momentum component to the multiplet structure so that the well-established Sugano-Tanabe-Kamimura diagrams can be used for the analysis of the spectra. For α-MnS we observe the spherical charge density corresponding to its high-spin 3d^{5} (^{6}A_{1}) ground state configuration and we were able to selectively image its excited states and identify them as t_{2g} (^{5}T_{2}) and e_{g} (^{5}E) with an energy splitting 10Dq of 0.78 eV.
format article
author A. Amorese
B. Leedahl
M. Sundermann
H. Gretarsson
Z. Hu
H.-J. Lin
C. T. Chen
M. Schmidt
H. Borrmann
Yu. Grin
A. Severing
M. W. Haverkort
L. H. Tjeng
author_facet A. Amorese
B. Leedahl
M. Sundermann
H. Gretarsson
Z. Hu
H.-J. Lin
C. T. Chen
M. Schmidt
H. Borrmann
Yu. Grin
A. Severing
M. W. Haverkort
L. H. Tjeng
author_sort A. Amorese
title Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS
title_short Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS
title_full Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS
title_fullStr Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS
title_full_unstemmed Selective Orbital Imaging of Excited States with X-Ray Spectroscopy: The Example of α-MnS
title_sort selective orbital imaging of excited states with x-ray spectroscopy: the example of α-mns
publisher American Physical Society
publishDate 2021
url https://doaj.org/article/8119911786f34b4d8523ba51bc156e65
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