Electronic structure of the organic semiconductor copper phthalocyanine: experiment and theory

The Journal of Chemical Physics
V Yu AristovMartin Knupfer

Abstract

The electronic structure of the organic semiconductor copper-phthalocyanine (CuPc) has been determined by a combination of conventional and resonant photoemission, near-edge x-ray absorption, as well as by the first-principles calculations. The experimentally obtained electronic valence band structure of CuPc is in very good agreement with the calculated density of states results, allowing the derivation of detailed site specific information.

References

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May 23, 2003·Acta Crystallographica. Section B, Structural Science·Akitaka HoshinoHideki Miyaji
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Citations

Mar 16, 2013·Analytical and Bioanalytical Chemistry·Florian LatteyerThomas Chassé
May 27, 2009·The Journal of Chemical Physics·H PeisertT Chassé
Nov 26, 2009·Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry·Holger HintzThomas Chassé
Jun 29, 2013·Physical Chemistry Chemical Physics : PCCP·Marco Vittorio NardiMaurizio Casarin
Sep 25, 2017·The Journal of Chemical Physics·Yahong ZhangGuangjiu Zhao
Nov 22, 2011·Inorganic Chemistry·Alexander M WhyteNeil Robertson
May 20, 2020·ACS Omega·Olga V MolodtsovaVictor Yu Aristov

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Methods Mentioned

BETA
electron diffraction

Software Mentioned

CRYSTAL

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