Role of intermolecular interactions on the electronic and geometric structure of a large π-conjugated molecule adsorbed on a metal surface

被引:140
作者
Kilian, L. [2 ]
Hauschild, A. [1 ]
Temirov, R. [3 ]
Soubatch, S. [3 ]
Schoell, A. [2 ]
Bendounan, A. [2 ]
Reinert, F. [2 ]
Lee, T. -L. [4 ]
Tautz, F. S. [3 ]
Sokolowski, M. [1 ]
Umbach, E. [2 ]
机构
[1] Univ Bonn, Inst Phys & Theoret Chem, D-53115 Bonn, Germany
[2] Univ Wurzburg, Expt Phys 2, D-97074 Wurzburg, Germany
[3] Jacobs Univ Bremen, Sch Sci & Engn, D-750761 Bremen, Germany
[4] European Synchrotron Radiat Facil, F-38043 Grenoble, France
关键词
D O I
10.1103/PhysRevLett.100.136103
中图分类号
O4 [物理学];
学科分类号
0702 ;
摘要
The organic semiconductor molecule 3,4,9,10-perylene-tetracarboxylic-dianhydride (PTCDA) exhibits two adsorption states on the Ag(111) surface: one in a metastable disordered phase, prepared at low temperatures, the other in the long-range ordered monolayer phase obtained at room temperature. Notably, the two states differ substantial in their vertical bonding distances, intramolecular distortions, and electronic structures. The difference is explained by intermolecular interactions, which are particularly relevant for the long-range ordered phase, and which hence require attention.
引用
收藏
页数:4
相关论文
共 18 条
[1]   Site-selective adsorption of naphthalene-tetracarboxylic-dianhydride on Ag(110): First-principles calculations [J].
Alkauskas, A ;
Baratoff, A ;
Bruder, C .
PHYSICAL REVIEW B, 2006, 73 (16)
[2]  
Barlow SM, 2003, SURF SCI REP, V50, P201, DOI [10.1016/S0167-5729(03)00015-3, 10.1016/s0167-5729(03)00015-3]
[3]   Influence of the reconstruction in Ag/Cu(111) on the surface electronic structure: Quantitative analysis of the induced band gap [J].
Bendounan, A ;
Forster, F ;
Ziroff, J ;
Schmitt, F ;
Reinert, F .
PHYSICAL REVIEW B, 2005, 72 (07)
[4]   Understanding and tuning the epitaxy of large aromatic adsorbates by molecular design [J].
Eremtchenko, M ;
Schaefer, JA ;
Tautz, FS .
NATURE, 2003, 425 (6958) :602-605
[5]   Adsorption-induced distortion of F16CuPc on Cu(111) and Ag(111):: An x-ray standing wave study -: art. no. 205425 [J].
Gerlach, A ;
Schreiber, F ;
Sellner, S ;
Dosch, H ;
Vartanyants, IA ;
Cowie, BCC ;
Lee, TL ;
Zegenhagen, J .
PHYSICAL REVIEW B, 2005, 71 (20)
[6]   Highly ordered structures and submolecular scanning tunnelling microscopy contrast of PTCDA and DM-PBDCI monolayers on Ag(111) and Ag(110) [J].
Glockler, K ;
Seidel, C ;
Soukopp, A ;
Sokolowski, M ;
Umbach, E ;
Bohringer, M ;
Berndt, R ;
Schneider, WD .
SURFACE SCIENCE, 1998, 405 (01) :1-20
[7]   Comment on "Molecular distortions and chemical bonding of a large π-conjugated molecule on a metal surface" -: Reply -: art. no. 209602 [J].
Hauschild, A ;
Karki, K ;
Cowie, BCC ;
Rohlfing, M ;
Tautz, FS ;
Sokolowski, M .
PHYSICAL REVIEW LETTERS, 2005, 95 (20)
[8]   Molecular distortions and chemical bonding of a large π-conjugated molecule on a metal surface -: art. no. 036106 [J].
Hauschild, A ;
Karki, K ;
Cowie, BCC ;
Rohlfing, M ;
Tautz, FS ;
Sokolowski, M .
PHYSICAL REVIEW LETTERS, 2005, 94 (03)
[9]  
HAUSCHILDETAL A, IN PRESS PHYS REV B
[10]   Vertical bonding distances of PTCDA on Au(111) and Ag(111): Relation to the bonding type [J].
Henze, S. K. M. ;
Bauer, O. ;
Lee, T. -L. ;
Sokolowski, M. ;
Tautz, F. S. .
SURFACE SCIENCE, 2007, 601 (06) :1566-1573