A New Alternative for the Low-Workfunction Electrode in Organic Devices

1999 ◽  
Vol 598 ◽  
Author(s):  
Norbert Koch ◽  
Egbert Zojer ◽  
Aparna Rajagopal ◽  
Jacques Ghijsen ◽  
Robert L. Johnson ◽  
...  

ABSTRACTThe application of ele ctroactive organic materials in devices (light emitting diodes, photovoltaic cells) often requires electrodes with a low workfunction. Commonly, aluminum or alkaline earth metals are used, which usually exhibit strong interaction with the organic material, such as the formation of new covalent bonds or doping. This results in a strong modification of the electronic structure of the organic/metal interface, and in most cases does not yield the energy level alignment expected for the unreacted interface. As a n alternative to the above-mentioned metals we propose the use of samarium, with a workfunction of 2.7 eV, for the following reason: we have studied the interface formation between Sm and p -sexiphenyl (6P, which exhibits intense blue electroluminescence), with ultraviolet photoelectron spectroscopy. Sm was deposited stepwise onto thin films of 6P in ultrahigh vacuum, and the photoelectron spectra were recorded after each step. We did not find any indication for a strong interaction between the two materials. Metallic Sm is formed instantaneously and the valence electronic structure of 6P remains unchanged upon the metal deposition. The weak interaction at this interface allows one to determine the energy level alignment between a metal and an organic material in a direct manner from the photoelectron spectra, without the need for making any assumptions on the workfunction or ionization potential.

2006 ◽  
Vol 965 ◽  
Author(s):  
Eiji Kawabe ◽  
Hiroyuki Yamane ◽  
Kenji Koizumi ◽  
Ryohei Sumii ◽  
Kaname Kanai ◽  
...  

ABSTRACTWe investigated the electronic structure and the energy level alignment at the interfaces between perylene-3,4,9,10-tetracarboxylic dianhydride (PTCDA) and metals (Au, Cu and Co) by ultraviolet photoelectron spectroscopy (UPS). In the case of PTCDA/Au interface, the apparent interface states and charge transfer (CT) states were not observed in its UPS spectra. In the case of PTCDA/Cu and Co interfaces, however, we found that the CT from metal to PTCDA occurred, and that the apparent CT states were observed at PTCDA/Cu interface.


2006 ◽  
Vol 252 (22) ◽  
pp. 8015-8017 ◽  
Author(s):  
J.H. Seo ◽  
S.J. Kang ◽  
C.Y. Kim ◽  
S.W. Cho ◽  
K.-H. Yoo ◽  
...  

1997 ◽  
Vol 75 (12) ◽  
pp. 1851-1861 ◽  
Author(s):  
Heidi M. Muchall ◽  
Nick H. Werstiuk ◽  
Jiangong Ma ◽  
Thomas T. Tidwell ◽  
Kuangsen Sung

The He(I) photoelectron spectra of silylketenes (Me3Si)2C=C=O (1), Me5Si2CH=C=O (2), Me2Si(CH=C=O)2 (3), MeSi(CH=C=O)3 (4), (SiMe2CH=C=O)2 (5), and (CH2SiMe2CH=C=O)2 (6) have been recorded and their structures and orbital energies have been calculated by ab initio methods. Orbital energies for disilanes 2 and 5 are strongly dependent on a Si-Si-C-C torsional angle due to σ–π orbital interaction. Comparisons between experimental and simulated spectra show that 2 and 5 prefer conformations in which the Si—Si bond and ketene group(s) are approximately orthogonal (113° and 111°, respectively). Silylalkenes Me5Si2CH=CH2 (7) and (SiMe2CH=CH2)2 (8), which have been included in the computational study, show the same behavior as their corresponding silylketenes. Silylbis- and trisketenes 3–6 do not exhibit π–π interaction of any significance. For Si—Si containing compounds, the best agreement between experimental and computed data was obtained when Becke3LYP/6-31G*//HF/3-21G* was employed. Keywords: conformational behavior, electronic structure, photoelectron spectroscopy, quantum chemical calculations, silylketenes.


2006 ◽  
Author(s):  
C. Y. Kim ◽  
J. H. Seo ◽  
S. W. Cho ◽  
K. -H. Yoo ◽  
C. N. Whang ◽  
...  

1996 ◽  
Vol 03 (01) ◽  
pp. 411-415 ◽  
Author(s):  
A. NAKAJIMA ◽  
T. TAGUWA ◽  
K. NAKAO ◽  
M. GOMEI ◽  
R. KISHI ◽  
...  

Photoelectron spectra of [Formula: see text] cluster anions (3≤n, m≤6) were measured at the photon energy of 3.49 eV, by using a magnetic-bottle electron spectrometer having ~60-meV resolution. The [Formula: see text] clusters were produced by laser vaporization of a carbon–silicon mixture rod in a He carrier gas. The spectra of the [Formula: see text] clusters are similar to those of pure [Formula: see text] clusters in the peak positions and their envelopes, which is attributed to the similarity in electronic structure of Si and C atoms, leading to a similar geometry. In contrast, the similarity in the photoelectron spectra is not observed between [Formula: see text] and [Formula: see text] clusters, which is attributed to a change in their geometry; from chain to ring.


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