Vibrationally resolved O 1s photoelectron spectrum of water

R. Sankari, M. Ehara, H. Nakatsuji, Y. Senba, K. Hosokawa, H. Yoshida, A. De Fanis, Y. Tamenori, S. Aksela, K. Ueda

Research output: Contribution to journalArticlepeer-review

90 Citations (Scopus)

Abstract

The O 1s photoelectron spectrum of water was recorded with the resolution high enough to resolve the vibrational structure of the O 1s-1 state and the lifetime width and the Franck-Condon (FC) factors were extracted. The experimental spectrum was reproduced well by the molecular ab initio calculations based on the symmetry adapted cluster-configuration interaction (SAC-CI) method. The vibrational structure was attributed mostly to the bending mode of the core-ionized molecule.

Original languageEnglish
Pages (from-to)647-653
Number of pages7
JournalChemical Physics Letters
Volume380
Issue number5-6
DOIs
Publication statusPublished - 2003 Oct 28

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

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