@articleAldahhak_Matencio_Barrena_Ocal_Schmidt_Rauls_2015, title=Structure formation in diindenoperylene thin films on copper(111), volume=17, DOI=10.1039/c4cp05271d, journal=Physical Chemistry Chemical Physics, author=Aldahhak, Hazem and Matencio, S. and Barrena, E. and Ocal, C. and Schmidt, Wolf Gero and Rauls, E., year=2015, pages=8776–8783 

@articleSanson_Zaltron_Argiolas_Sada_Bazzan_Schmidt_Sanna_2015, title=Polaronic deformation at theFe2+/3+impurity site inFe:LiNbO3crystals, volume=91, DOI=10.1103/physrevb.91.094109, journal=Physical Review B, author=Sanson, A. and Zaltron, A. and Argiolas, N. and Sada, C. and Bazzan, M. and Schmidt, Wolf Gero and Sanna, S., year=2015 

@articleLandmann_Rauls_Schmidt_Neumann_Speiser_Esser_2015, title=GaNm-plane: Atomic structure, surface bands, and optical response, volume=91, DOI=10.1103/physrevb.91.035302, journal=Physical Review B, author=Landmann, M. and Rauls, E. and Schmidt, Wolf Gero and Neumann, M. D. and Speiser, E. and Esser, N., year=2015 

@articleNeuba_Rohrmüller_Hölscher_Schmidt_Henkel_2015, title=A panel of peralkylated sulfur–guanidine type bases: Novel pro-ligands for use in biomimetic coordination chemistry, volume=430, DOI=10.1016/j.ica.2015.03.015, journal=Inorganica Chimica Acta, author=Neuba, Adam and Rohrmüller, Martin and Hölscher, Rebecca and Schmidt, Wolf Gero and Henkel, Gerald, year=2015, pages=225–238 

@articleOreshnikov_Driben_Yulin_2015, title=Interaction of high-order solitons with external dispersive waves, DOI=10.1364/ol.40.005554, number=5554, journal=Optics Letters, author=Oreshnikov, I. and Driben, R. and Yulin, A. V., year=2015 

@articleHölscher_Schmidt_Sanna_2014, title=Modeling LiNbO3 Surfaces at Ambient Conditions, DOI=10.1021/jp502936f, journal=The Journal of Physical Chemistry C, author=Hölscher, Rebecca and Schmidt, Wolf Gero and Sanna, Simone, year=2014, pages=10213–10220 

@articleGuo_Paulheim_Sokolowski_Aldahhak_Rauls_Schmidt_2014, title=Adsorption of PTCDA on Terraces and at Steps Sites of the KCl(100) Surface, volume=118, DOI=10.1021/jp509663s, journal=The Journal of Physical Chemistry C, author=Guo, Q. and Paulheim, A. and Sokolowski, M. and Aldahhak, Hazem and Rauls, E. and Schmidt, Wolf Gero, year=2014, pages=29911–29918 

@articleOh_Wippermann_Schmidt_Yeom_2014, title=Oxygen adsorbates on the Si(111)4×1-In metallic atomic wire: Scanning tunneling microscopy and density-functional theory calculations, volume=90, DOI=10.1103/physrevb.90.155432, number=15, journal=Physical Review B, author=Oh, Deok Mahn and Wippermann, S. and Schmidt, Wolf Gero and Yeom, Han Woong, year=2014 

@articleHoffmann_Rohrmüller_Jesser_dos Santos Vieira_Schmidt_Herres-Pawlis_2014, title=Geometrical and optical benchmarking of copper(II) guanidine-quinoline complexes: Insights from TD-DFT and many-body perturbation theory (part II), volume=35, DOI=10.1002/jcc.23740, number=29–30, journal=Journal of Computational Chemistry, author=Hoffmann, Alexander and Rohrmüller, Martin and Jesser, Anton and dos Santos Vieira, Ines and Schmidt, Wolf Gero and Herres-Pawlis, Sonja, year=2014, pages=2146–2161 

@articleLandmann_Köhler_Rauls_Frauenheim_Schmidt_2014, title=The atomic structure of ternary amorphous TixSi1xO2hybrid oxides, volume=26, DOI=10.1088/0953-8984/26/25/253201, number=253201, journal=Journal of Physics: Condensed Matter, author=Landmann, M and Köhler, T and Rauls, E and Frauenheim, T and Schmidt, Wolf Gero, year=2014 

@articleSanna_Schmidt_Thissen_2014, title=Formation of Hydroxyl Groups at Calcium-Silicate-Hydrate (C-S-H): Coexistence of Ca–OH and Si–OH on Wollastonite(001), volume=118, DOI=10.1021/jp500170t, journal=The Journal of Physical Chemistry C, author=Sanna, Simone and Schmidt, Wolf Gero and Thissen, Peter, year=2014, pages=8007–8013 

@articleGerstmann_Vollmers_Lücke_Babilon_Schmidt_2014, title=Rashba splitting and relativistic energy shifts in In/Si(111) nanowires, volume=89, DOI=10.1103/physrevb.89.165431, number=16, journal=Physical Review B, author=Gerstmann, Uwe and Vollmers, N. J. and Lücke, A. and Babilon, M. and Schmidt, Wolf Gero, year=2014 

@articleLi_Schmidt_Sanna_2014, title=IntrinsicLiNbO3point defects from hybrid density functional calculations, volume=89, DOI=10.1103/physrevb.89.094111, number=9, journal=Physical Review B, author=Li, Yanlu and Schmidt, Wolf Gero and Sanna, S., year=2014 

@articleSanna_Hölscher_Schmidt_2014, title=Temperature dependent LiNbO3(0001): Surface reconstruction and surface charge, DOI=10.1016/j.apsusc.2014.01.104, journal=Applied Surface Science, author=Sanna, S. and Hölscher, R. and Schmidt, Wolf Gero, year=2014, pages=70–78 

@articleSanna_Schmidt_Rode_Klassen_Kühnle_2014, title=Unraveling theLiNbO3X-cut surface by atomic force microscopy and density functional theory, volume=89, DOI=10.1103/physrevb.89.075403, number=7, journal=Physical Review B, author=Sanna, S. and Schmidt, Wolf Gero and Rode, S. and Klassen, S. and Kühnle, A., year=2014 

@inbookRiefer_Rohrmüller_Landmann_Sanna_Rauls_Vollmers_Hölscher_Witte_Li_Gerstmann_et al._2013, place=Cham, series=Transactions of the High Performance Computing Center, Stuttgart, title=Lithium niobate dielectric function and second-order polarizability tensor from massively parallel ab initio calculations, DOI=10.1007/978-3-319-02165-2_8, booktitle=High Performance Computing in Science and Engineering ‘13, publisher=Springer, author=Riefer, Arthur and Rohrmüller, Martin and Landmann, Marc and Sanna, Simone and Rauls, Eva and Vollmers, Nora Jenny and Hölscher, Rebecca and Witte, Matthias and Li, Yanlu and Gerstmann, Uwe and et al., editor=Nagel, Wolfgang E. and Kröner, Dietmar H. and Resch, Michael M.Editors, year=2013, pages=93–104, collection=Transactions of the High Performance Computing Center, Stuttgart 

@articleJesser_Rohrmüller_Schmidt_Herres-Pawlis_2013, title=Geometrical and optical benchmarking of copper guanidine-quinoline complexes: Insights from TD-DFT and many-body perturbation theory, volume=35, DOI=10.1002/jcc.23449, number=1–2, journal=Journal of Computational Chemistry, author=Jesser, Anton and Rohrmüller, Martin and Schmidt, Wolf Gero and Herres-Pawlis, Sonja, year=2013, pages=1–17 

@articleFrigge_Wall_Krenzer_Wippermann_Sanna_Klasing_Hanisch-Blicharski_Kammler_Schmidt_Horn-von Hoegen_2013, title=Friggeet al.Reply:, volume=111, DOI=10.1103/physrevlett.111.149602, journal=Physical Review Letters, author=Frigge, T. and Wall, S. and Krenzer, B. and Wippermann, St. and Sanna, S. and Klasing, F. and Hanisch-Blicharski, A. and Kammler, M. and Schmidt, Wolf Gero and Horn-von Hoegen, M., year=2013, pages=149602 

@articleRiefer_Sanna_Schmidt_2013, title=LiNb1-xTaxO3Electronic Structure and Optical Response fromFirst-PrinciplesCalculations, volume=447, DOI=10.1080/00150193.2013.821904, journal=Ferroelectrics, author=Riefer, A. and Sanna, S. and Schmidt, Wolf Gero, year=2013, pages=78–85 

@articleSanna_Rode_Hölscher_Klassen_Marutschke_Kobayashi_Yamada_Schmidt_Kühnle_2013, title=Charge compensation by long-period reconstruction in strongly polar lithium niobate surfaces, volume=88, DOI=10.1103/physrevb.88.115422, journal=Physical Review B, author=Sanna, S. and Rode, S. and Hölscher, R. and Klassen, S. and Marutschke, C. and Kobayashi, K. and Yamada, H. and Schmidt, Wolf Gero and Kühnle, A., year=2013