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The vibrational overtone induced unimolecular dissociation of HMHP (HOCH2OOH) and HMHP-d2 (HOCD2OOH) into OH and HOCH2O (HOCD2O) fragments is investigated in the region of the 4OH and 5OH bands. The u...
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Probing interactions between core-electron transitions by ultrafast two-dimensional x-ray coherent correlation spectroscopy

J. Chem. Phys. 128, 184307 (2008); doi:10.1063/1.2839859

Published 12 May 2008

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Igor V. Schweigert and Shaul Mukamel
Department of Chemistry, University of California, Irvine, California 92697-2025, USA
Two-dimensional x-ray correlation spectra (2DXCS) obtained by varying two delay periods in a time-resolved coherent all-x-ray four-wave-mixing measurement are simulated for the N 1s and O 1s transitions of aminophenol. The necessary valence and core-excited states are calculated using singly and doubly substituted Kohn–Sham determinants within the equivalent-core approximation. Sum-over-states calculations of the 2DXCS signals of aminophenol isomers illustrate how novel information about electronic states can be extracted from the 2D spectra. Specific signatures of valence and core-excited states are identified in the diagonal and off-diagonal peaks arising from core transitions of the same and different types, respectively. ©2008 American Institute of Physics
History: Received 27 August 2007; accepted 14 January 2008; published 12 May 2008
Permalink: http://link.aip.org/link/?JCPSA6/128/184307/1
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KEYWORDS and PACS

Keywords
PACS
  • 78.70.Dm
    X-ray absorption spectra (condensed matter)
  • 33.20.Rm
    X-ray molecular spectra
  • YEAR: 2008

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ISSN:
0021-9606 (print)   1089-7690 (online)
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