Time-dependent Hartree-Fock calculations of surface-enhanced Raman intensities. H2 adsorbed on a model Li cluster

Prabhat K.K. Pandey*, George C. Schatz

*Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

22 Scopus citations

Abstract

Time-dependent Hartree-Fock theory is used to calculate frequency-dependent polarizability derivatives for H2 adsorbed on a model lithium cluster. The results indicate large enhancements in Raman intensity when H2 is close to its equilibrium adsorption distance.

Original languageEnglish (US)
Pages (from-to)193-197
Number of pages5
JournalChemical Physics Letters
Volume88
Issue number2
DOIs
StatePublished - Apr 30 1982

ASJC Scopus subject areas

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

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