Phthalocyanine dimers in a blend: Spectroscopic and theoretical studies of MnPcδ +/F16CoPcδ -

被引:16
作者
Lindner, Susi [1 ]
Mahns, Benjamin [1 ]
Koenig, Andreas [1 ]
Roth, Friedrich [1 ]
Knupfer, Martin [1 ]
Friedrich, Rico [2 ]
Hahn, Torsten [2 ]
Kortus, Jens [2 ]
机构
[1] IFW Dresden, D-01171 Dresden, Germany
[2] TU Bergakad Freiberg, Inst Theoret Phys, D-09696 Freiberg, Germany
关键词
ELECTRONIC-STRUCTURE; MANGANESE PHTHALOCYANINE; CHARGE-TRANSFER; APPROXIMATION; SIMULATIONS; INTENSITIES; INTERFACES; MOLECULE; GOLD;
D O I
10.1063/1.4774060
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We have prepared mixed phthalocyanine films out of MnPc and F16CoPc, which were characterized by means of photoemission spectroscopy and electron energy-loss spectroscopy. Our data reveal the formation of MnPc/F16CoPc charge transfer dimers in analogy to the related heterojunction. The electronic excitation spectrum of these blends is characterized by a new low energy excitation at 0.6 eV. Density functional theory calculations show that the new signal is caused by a strong absorption between the states of the interface induced two level system. (C) 2013 American Institute of Physics. [http://dx.doi.org/10.1063/1.4774060]
引用
收藏
页数:4
相关论文
共 33 条
[21]  
2-B
[22]  
Perdew JP, 1997, PHYS REV LETT, V78, P1396, DOI 10.1103/PhysRevLett.77.3865
[23]   Modification of the 3d-Electronic Configuration of Manganese Phthalocyanine at the Interface to Gold [J].
Petraki, F. ;
Peisert, H. ;
Hoffmann, P. ;
Uihlein, J. ;
Knupfer, M. ;
Chasse, T. .
JOURNAL OF PHYSICAL CHEMISTRY C, 2012, 116 (08) :5121-5127
[24]   Electronic Structure of Co-Phthalocyanine on Gold Investigated by Photoexcited Electron Spectroscopies: Indication of Co Ion-Metal Interaction [J].
Petraki, F. ;
Peisert, H. ;
Biswas, I. ;
Chasse, T. .
JOURNAL OF PHYSICAL CHEMISTRY C, 2010, 114 (41) :17638-17643
[25]  
Pope M., 1999, Electronic Processes in Organic Crystals and Polymers
[26]   Optimization of Gaussian basis sets for density-functional calculations [J].
Porezag, D ;
Pederson, MR .
PHYSICAL REVIEW A, 1999, 60 (04) :2840-2847
[27]   Infrared intensities and Raman-scattering activities within density-functional theory [J].
Porezag, D ;
Pederson, MR .
PHYSICAL REVIEW B, 1996, 54 (11) :7830-7836
[28]  
Porezag D., 1997, THESIS TU CHEMNITZ Z
[29]   1ST PRINCIPLES DETERMINATION OF THE INTERATOMIC FORCE-CONSTANT TENSOR OF THE FULLERENE MOLECULE [J].
QUONG, AA ;
PEDERSON, MR ;
FELDMAN, JL .
SOLID STATE COMMUNICATIONS, 1993, 87 (06) :535-539
[30]  
Seah M. P., 1979, Surface and Interface Analysis, V1, P2, DOI 10.1002/sia.740010103