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Title: Probing The Electronic Properties of Dichromium Oxide Clusters Cr2On-(n=1-7) Using Photoelectron Spectroscopy

Journal Article · · Journal of Chemical Physics, 125(16):Art. No. 164315
DOI:https://doi.org/10.1063/1.2360531· OSTI ID:918863

In an effort to elucidate the variation of the electronic structure as a function of oxidation and composition, we investigated an extensive series of dichromium oxide clusters, Cr2On- (n = 1-7) using photoelectron spectroscopy (PES). Well-resolved PES spectra were obtained at several photon energies. While low photon energy spectra yielded much better spectral resolution, high photon energy data allowed both Cr 3d- and O 2p-dreived detachment features to be observed. The overall spectral evolution of Cr2On– exhibits a behavior of sequential oxidation with increasing oxygen content, where low binding energy Cr 3d-based spectral features diminish in numbers and the spectra shift towards higher binding energies as a result of charge transfer from Cr to O. Evidence was obtained for the population of low-lying isomers for Cr2O2-, Cr2O3-, and Cr2O6-. The current data are compared with previous studies and with related studies on W2On- and Mo2On-.

Research Organization:
Pacific Northwest National Lab. (PNNL), Richland, WA (United States). Environmental Molecular Sciences Lab. (EMSL)
Sponsoring Organization:
USDOE
DOE Contract Number:
AC05-76RL01830
OSTI ID:
918863
Report Number(s):
PNNL-SA-52195; JCPSA6; 1391a; 17812; 3227a; KC0301020; TRN: US0805918
Journal Information:
Journal of Chemical Physics, 125(16):Art. No. 164315, Vol. 125, Issue 16; ISSN 0021-9606
Country of Publication:
United States
Language:
English