Kettner, M.; Benedikt, U.; Schneider, W.; Auer, A. A.: Computational Study of Pt/Co Core-Shell Nanoparticles: Segregation, Adsorbates and Catalyst Activity. Journal of Physical Chemistry C 116 (29), pp. 15432 - 15438 (2012)

Azzam, W.; Bashir, A.; Biedermann, P. U.; Rohwerder, M.: Formation of highly ordered and orientated gold islands: Effect of immersion time on the molecular adlayer structure of pentafluorobenzenethiols (PFBT) SAMs on Au(111). Langmuir 28 (27), pp. 10192 - 10208 (2012)

Auer, A. A.; Richter, A.; Berezkin, A. V.; Guseva, D. V.; Spange, S.: Theoretical study of twin polymerization – From chemical reactivity to structure formation. Macromolecular Theory Simulations 21 (9), pp. 615 - 628 (2012)

Banert, K.; Arnold, R.; Hagedorn, M.; Thoss, P.; Auer, A. A.: 1-Azido-1-Alkynes: Synthesis and Spectroscopic Characterization of Azidoacetylene. Angew. Chem. 124, pp. 1 - 5 (2012)

Katsounaros, I.; Schneider, W.; Meier, J. C.; Benedikt, U.; Biedermann, P. U.; Auer, A. A.; Mayrhofer, K. J. J.: Hydrogen peroxide electrochemistry on platinum: Towards understanding the oxygen reduction reaction mechanism. Physical Chemistry and Chemical Physics 14, pp. 7384 - 7391 (2012)

Auinger, M.; Katsounaros, I.; Meier, J. C.; Klemm, S. O.; Biedermann, P. U.; Topalov, A. A.; Rohwerder, M.; Mayrhofer, K. J. J.: Near-surface ion distribution and buffer effects during electrochemical reactions. Physical Chemistry Chemical Physics 13 (36), pp. 16384 - 16394 (2011)

Firdous, S.; Banert, K.; Auer, A. A.: Viability of 4,5-Dihydro-1,2,3,4-oxatriazoles Reinvestigated. Chemistry-A European Journal 17 (20), pp. 5539 - 5543 (2011)

Wójcik, K.; Rueffer, T.; Lang, H.; Auer, A. A.; Mehring, M.: Novel carbonyl iron-bismuth clusters - Synthesis, structure, CO₂ insertion and potential as molecular precursors for BiFeO₃. Journal of Organometallic Chemistry 696 (8), pp. 1647 - 1651 (2011)

Torres, E.; Blumenau, A. T.; Biedermann, P. U.: Steric and Chain Length Effects in the (√(3) x √(3))R30°Structures of Alkanethiol Self-Assembled Monolayers on Au(111). ChemPhysChem 12, pp. 999 - 1009 (2011)

Auer, A. A.; Kästner, J.; Burghardt, I.: Trendberichte Theoretische Chemie 2010 - Tensorzerlegungen. Nachrichten aus der Chemie 59 (3), pp. 284 - 286 (2011)

Benedikt, U.; Auer, A. A.; Espig, M.; Hackbusch, W.: Tensor decomposition in post-Hartree-Fock methods. I. Two-electron integrals and MP2. Journal of Chemical Physics 134 (5), 054118, pp. 1 - 12 (2011)

Katsounaros, I.; Meier, J. C.; Klemm, S. O.; Topalov, A. A.; Biedermann, P. U.; Auinger, M.; Mayrhofer, K. J. J.: The effective surface pH during reactions at the solid–liquid interface. Electrochemistry Communications 13 (6), pp. 634 - 637 (2011)

Hamou, F. R.; Biedermann, P. U.; Erbe, A.; Rohwerder, M.: Numerical analysis of Debye screening effect in electrode surface potential mapping by scanning electrochemical potential microscopy. Electrochemistry Communucations 12 (10), pp. 1391 - 1394 (2010)

Hamou, F. R.; Biedermann, P. U.; Erbe, A.; Rohwerder, M.: Numerical simulation of probing the electric double layer by scanning electrochemical potential microscopy. Electrochimica Acta 55 (18), pp. 5210 - 5222 (2010)

Torres, E.; Biedermann, P. U.; Blumenau, A. T.: The Role of Gold Adatoms in Self-Assembled Monolayers of Thiol on Au(111). Sp. Iss. SI, pp. 3466 - 3472 (2009)

Torres, E.; Blumenau, A. T.; Biedermann, P. U.: Mechanism for phase transitions and vacancy island formation in alkylthiol/Au(111)self-assembled monolayers based on adatom and vacancy-induced reconstructions. Physical Review B 79 (7), pp. 075440-1 - 075440-6 (2009)

Scalise, E.: Theoretical study of transition metal dichalcogenides. In: 2D Materials for Nanoelectronics, pp. 141 - 162 (2016)

Interaction of silicene and germanene with non-metallic substrates (Journal of Physics: Conference Series, 574). 3rd International Conference on Mathematical Modeling in Physical Sciences, IC-MSQUARE 2014, Madrid, Spain, August 28, 2014 - August 31, 2014. (2014)

Pengel, S.; Niu, F.; Nayak, S.; Tecklenburg, S.; Chen, Y.-H.; Ebbinghaus, P.; Schulz, R.; Yang, L.; Biedermann, P. U.; Gygi, F. et al.; Schmid, R.; Galli, G.; Wippermann, S. M.; Erbe, A.: Oxygen reduction and water at the semiconductor/solution interface probed by stationary and time-resolved ATR-IR spectroscopy coupled to electrochemical experiments and DFT calculations. In: Program of the 8th International Conference on Advanced Vibrational Spectroscopy (ICAVS) – Oral Abstracts, pp. 130 - 131 (Eds. Lendl, B.; Koch, C.; Kraft, M.; Ofner, J.; Ramer, G.). 8th International Conference on Advanced Vibrational Spectroscopy (ICAVS), Vienna, Austria, July 12, 2015 - July 17, 2015. (2015)

Vörös, M.; Wippermann, S. M.; Gali, A.; Gygi, F.; Zimanyi, G. T.; Galli, G.: Exotic phase Si nanoparticles and Si–ZnS nanocomposites: New paradigms to improve the efficiency of MEG solar cells. In: 2014 IEEE 40th Photovoltaic Specialist Conference, PVSC 2014, 6925670, pp. 3432 - 3434. 40th IEEE Photovoltaic Specialist Conference, PVSC 2014, Denver, CO, USA, June 08, 2014 - June 13, 2014. (2014)