Publications of Wei Liu

Dostert, K.-H.; O'Brien, C.; Liu, W.; Riedel, W.; Savara, A. A.; Tkatchenko, A.; Schauermann, S.; Freund, H.-J.: Adsorption of isophorone and trimethyl-cyclohexanone on Pd(111): A combination of infrared reflection absorption spectroscopy and density functional theory studies. Surface Science 650, pp. 149 - 160 (2016)

Maurer, R. J.; Liu, W.; Poltavskyi, I.; Stecher, T.; Oberhofer, H.; Reuter, K.; Reuter, K.; Tkatchenko, A.: Thermal and electronic fluctuations of flexible adsorbed molecules: Azobenzene on Ag(111). Physical Review Letters 116 (14), 146101 (2016)

Liu, W.; Schuler, B.; Xu, Y.; Moll, N.; Meyer, G.; Gross, L.; Tkatchenko, A.: Identical Binding Energies and Work Functions for Distinct Adsorption Structures: Olympicenes on the Cu(111) Surface. The Journal of Physical Chemistry Letters 7 (6), pp. 1022 - 1027 (2016)

Ruiz Lopez, V. G.; Liu, W.; Tkatchenko, A.: Density-functional theory with screened van der Waals interactions applied to atomic and molecular adsorbates on close-packed and non-close-packed surfaces. Physical Review B 93 (3), 035118 (2016)

Cisnéros, J. C.; Liu, W.; Tkatchenko, A.: Steps or Terraces? Dynamics of Aromatic Hydrocarbons Adsorbed at Vicinal Metal Surfaces. Physical Review Letters 115 (8), 086101 (2015)

Liu, W.; Maaß, F.; Willenbockel, M.; Bronner, C.; Schulze, M.; Soubatch, S.; Tautz, F. S.; Tegeder, P.; Tkatchenko, A.: Quantitative Prediction of Molecular Adsorption: Structure and Binding of Benzene on Coinage Metals. Physical Review Letters 115 (3), 036104 (2015)

Dostert, K.-H.; O'Brien, C.; Riedel , W.; Savara, A. A.; Liu, W.; Oehzelt, M.; Tkatchenko, A.; Schauermann, S.: Interaction of Isophorone with Pd(111): A Combination of Infrared Reflection–Absorption Spectroscopy, Near-Edge X-ray Absorption Fine Structure, and Density Functional Theory Studies. The Journal of Physical Chemistry C 118 (48), pp. 27833 - 27842 (2014)

Liu, W.; Tkatchenko, A.; Scheffler, M.: Modeling Adsorption and Reactions of Organic Molecules at Metal Surfaces. Accounts of Chemical Research 47 (11), pp. 3369 - 3377 (2014)

Rodriguez-Reyes, J. C. F.; Siler, C. G.F.; Liu, W.; Tkatchenko, A.; Friend, C. M.; Madix, R. J.: van der Waals Interactions Determine Selectivity in Catalysis by Metallic Gold. Journal of the American Chemical Society 136 (38), pp. 13333 - 13340 (2014)

Schuler, B.; Liu, W.; Tkatchenko, A.; Moll, N.; Meyer, G.; Mistry, A.; Fox, D.; Gross, L.: Publisher’s Note: Adsorption Geometry Determination of Single Molecules by Atomic Force Microscopy [Phys. Rev. Lett. 111, 106103 (2013)]. Physical Review Letters 112 (12), 129902 (2014)

Carrasco, J.; Liu, W.; Michaelides, A.; Tkatchenko, A.: Insight into the description of van der Waals forces for benzene adsorption on transition metal (111) surfaces. The Journal of Chemical Physics 140 (8), 084704 (2014)

Liu, W.; Filimonov, S.; Carrasco, J.; Tkatchenko, A.: Molecular switches from benzene derivatives adsorbed on metal surfaces. Nature Communications 4, 2569 (2013)

Schuler, B.; Liu, W.; Tkatchenko, A.; Moll, N.; Meyer, G.; Mistry, A.; Fox, D.; Gross, L.: Adsorption geometry determination of single molecules by atomic force microscopy. Physical Review Letters 111 (10), 106103 (2013)

Mercurio, G.; Maurer, R. J.; Liu, W.; Hagen, S.; Leyssner, F.; Tegeder, P.; Meyer, J.; Tkatchenko, A.; Soubatch, S.; Reuter, K. et al.; Tautz, F. S.: Quantification of finite-temperature effects on adsorption geometries of π-conjugated molecules: Azobenzene/Ag(111). Physical Review B 88 (3), 035421 (2013)

Liu, W.; Ruiz, V. G.; Zhang, G.-X.; Santra, B.; Ren, X.; Scheffler, M.; Tkatchenko, A.: Structure and energetics of benzene adsorbed on transition-metal surfaces: density-functional theory with van der Waals interactions including collective substrate response. New Journal of Physics 15 (5), 053046 (2013)

Liu, W.; Carrasco, J.; Santra, B.; Michaelides, A.; Scheffler, M.; Tkatchenko, A.: Benzene adsorbed on metals: Concerted effect of covalency and van der Waals bonding. Physical Review B 86 (24), 245405 (2012)

Ruiz, V. G.; Liu, W.; Zojer, E.; Scheffler, M.; Tkatchenko, A.: Density-Functional Theory with Screened van der Waals Interactions for the Modeling of Hybrid Inorganic-Organic Systems. Physical Review Letters 108 (14), 146103 (2012)

Liu, W.; Savara, A. A.; Ren, X.; Ludwig, W.; Dostert, K.-H.; Schauermann, S.; Tkatchenko, A.; Freund, H.-J.; Scheffler, M.: Toward Low-Temperature Dehydrogenation Catalysis: Isophorone Adsorbed on Pd(111). The Journal of Physical Chemistry Letters 3 (5), pp. 582 - 586 (2012)