Photoelectron spectra and electronic structure of nitrogen analogues of boron β-diketonates with aromatic substituents

Sergey A. Tikhonov,Vitaliy I. Vovna,Aleksandr V. Borisenko

Journal of Electron Spectroscopy and Related Phenomena（2016）

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摘要

•The electronic structures of three nitrogen analogues of boron β-diketonates have been investigated.•UV photoelectron spectra have been interpreted.•The structure of the UV photoelectron spectra is in good agreement with the energies and compositions of Kohn-Sham orbitals.

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关键词

Electronic structure,Photoelectron spectra,Density functional theory,β-Diketonates,Boron formazanates

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