% IMPORTANT: The following is UTF-8 encoded.  This means that in the presence
% of non-ASCII characters, it will not work with BibTeX 0.99 or older.
% Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or
% “biber”.

@ARTICLE{Puschnig:20701,
      author       = {Puschnig, P. and Reinisch, E.-M. and Ules, T. and Koller,
                      G. and Soubatch, S. and Ostler, M. and Romaner, L. and
                      Tautz, F.S. and Ambrosch-Draxl, C. and Ramsey, M.G.},
      title        = {{O}rbital tomography: {D}econvoluting photoemission spectra
                      of organic molecules},
      journal      = {Physical review / B},
      volume       = {84},
      number       = {23},
      issn         = {1098-0121},
      address      = {College Park, Md.},
      publisher    = {APS},
      reportid     = {PreJuSER-20701},
      pages        = {235427},
      year         = {2011},
      note         = {We acknowledge financial support from the Austrian Science
                      Fund (FWF), projects S97-04 and S97-14 and P21330-N20 and
                      P23190-N16, and from the Deutsche Forschungsgemeinschaft,
                      project TA-244. We further acknowledge the
                      Helmholtz-Zentrum-Berlin, Electron storage ring BESSY II for
                      provision of synchrotron radiation at beamline U125/2-SGM,
                      and in particular we thank Dr. Christian
                      Schussler-Langeheine for assistance. We would also like to
                      thank Prof. Falko P. Netzer and Prof. Thomas Seyller for
                      discussions. The research leading to these results has
                      received funding from the European Community's Seventh
                      Framework Programme (FP7/2007-2013) under grant agreement
                      number 226716.},
      abstract     = {We study the interface of an organic monolayer with a
                      metallic surface, i.e., PTCDA
                      (3,4,9,10-perylene-tetracarboxylic-dianhydride) on Ag(110),
                      by means of angle-resolved photoemission spectroscopy
                      (ARPES) and ab initio electronic structure calculations. We
                      present a tomographic method that uses the energy and
                      momentum dependence of ARPES data to deconvolute spectra
                      into individual orbital contributions beyond the limits of
                      energy resolution. This provides an orbital-by-orbital
                      characterization of large adsorbate systems without the need
                      to invoke a sophisticated theory of photoemission, allowing
                      us to directly estimate the effects of bonding on individual
                      orbitals. Moreover, these experimental data serve as a most
                      stringent test necessary for the further development of ab
                      initio electronic structure theory.},
      keywords     = {J (WoSType)},
      cin          = {PGI-3 / JARA-FIT},
      ddc          = {530},
      cid          = {I:(DE-Juel1)PGI-3-20110106 / $I:(DE-82)080009_20140620$},
      pnm          = {Grundlagen für zukünftige Informationstechnologien /
                      ELISA - European Light Sources Activities - Synchrotrons and
                      Free Electron Lasers (226716)},
      pid          = {G:(DE-Juel1)FUEK412 / G:(EU-Grant)226716},
      shelfmark    = {Physics, Condensed Matter},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000298115400006},
      doi          = {10.1103/PhysRevB.84.235427},
      url          = {https://juser.fz-juelich.de/record/20701},
}