Publications of Timo Jacob

Journal Article (19)

Journal Article
W. Zheng, T.P. Cotter, P. Kaghazchi, T. Jacob, B. Frank, K. Schlichte, W. Zhang, D.S. Su, F. Schüth and R. Schlögl: Experimental and Theoretical Investigation of Molybdenum Carbide and Nitride as Catalysts for Ammonia Decomposition. Journal of the American Chemical Society 135 (9), 3458–3464 (2013).
Journal Article
W. Chen, A.L. Stottlemyer, J.G. Chen, P. Kaghazchi, T. Jacob, T.E. Madey and R.A. Bartynski: Adsorption and decomposition of NO on O-covered planar and faceted Ir(2 1 0). Surface Science 603 (20), 3136–3144 (2009).
Journal Article
W. Chen, T.E. Madey, A.L. Stottlemyer, J.G. Chen, P. Kaghazchi and T. Jacob: Structure sensitivity in adsorption and decomposition of NO on Ir. The Journal of Physical Chemistry C 112 (48), 19113–19120 (2008).
Journal Article
T.E. Madey, W. Chen, H. Wang, P. Kaghazchi and T. Jacob: Nanoscale surface chemistry over faceted substrates: structure, reactivity and nanotemplates. Chemical Society Reviews 37 (10), 2310–2327 (2008).
Journal Article
A. Wiltner, C. Linsmeier and T. Jacob: Carbon reaction and diffusion on Ni(111), Ni(100), and Fe(110): Kinetic parameters from x-ray photoelectron spectroscopy and density functional theory analysis. The Journal of Chemical Physics 129 (8), 084704 (2008).
Journal Article
P. Kaghazchi, T. Jacob, I. Ermanoski, W. Chen and T.E. Madey: First-principles studies on oxygen-induced faceting of Ir(210). ACS Nano 2 (6), 1280–1288 (2008).
Journal Article
S. Venkatachalam, P. Kaghazchi, L.A. Kibler, D.M. Kolb and T. Jacob: First principles studies of the potential-induced lifting of the Au(100) surface reconstruction. Chemical Physics Letters 455 (1-3), 47–51 (2008).
Journal Article
P. Kaghazchi, F.C. Simeone, K.A. Soliman, L.A. Kibler and T. Jacob: Bridging the gap between nanoparticles and single crystal surfaces. Faraday Discussions 140, 69–80 (2008).
Journal Article
D.S. Su, T. Jacob, T.W. Hansen, D. Wang, R. Schlögl, B. Freitag and S. Kujawa: Surface Chemistry of Ag Particles: Identification of Oxide Species by Aberration-Corrected TEM and by DFT Calculations. Angewandte Chemie International Edition 47 (27), 5005–5008 (2008).
Journal Article
P. Kaghazchi and T. Jacob: First-principles studies on clean and oxygen-adsorbed Ir(110) surfaces. Physical Review B 76 (24), 245425 (2007).
Journal Article
H. Wang, A.S.Y. Chan, W. Chen, P. Kaghazchi, T. Jacob and T.E. Madey: Facet stability in oxygen-induced nanofaceting of Re(1231). ACS Nano 1 (5), 449–455 (2007).
Journal Article
F.C. Simeone, D.M. Kolb, S. Venkatachalam and T. Jacob: The Au(111)/Electrolyte Interface: A Tunnel-Spectroscopic and DFT Investigation. Angewandte Chemie International Edition 46 (46), 8903–8906 (2007).
Journal Article
F.C. Simeone, D.M. Kolb, S. Venkatachalam and T. Jacob: Die Au(111)-Elektrolyt-Grenzschicht: eine Tunnelspektroskopie- und DFT-Untersuchung. Angewandte Chemie 119 (46), 9061–9064 (2007).
Journal Article
S. Piskunov, E. Spohr, T. Jacob, E.A. Kotomin and D.E. Ellis: Electronic and magnetic structure of La0.875Sr0.125MnO3 calculated by means of hybrid density-functional theory. Physical Review B 76 (1), 012410 (2007).
Journal Article
S. Venkatachalam and T. Jacob: DFT Studies on the nature of coadsorbates on SO42-/Au(111). Zeitschrift für Physikalische Chemie 221 (9-10), 1393–1406 (2007).
Journal Article
T. Jacob: Theoretical investigations on the potential-induced formation of Pt-oxide surfaces. Journal of Electroanalytical Chemistry 607 (1-2), 158–166 (2007).
Journal Article
W. Vogel, P. Kaghazchi, T. Jacob and N. Alonso-Vante: Genesis of RuxSey nanoparticles by pyrolysis of Ru4Se2(CO)11: A combined X-ray in situ and DFT study. Journal of Physical Chemistry C 111 (10), 3908–3913 (2007).
Journal Article
T. Jacob, M. Blanco and W.A. Goddard III: Linking molecular switches to platinum electrodes studied with DFT. Journal of Physical Chemistry C 111 (6), 2749–2758 (2007).
Journal Article
T. Jacob: Potential-induced lifting of the Au(1 0 0)-surface reconstruction studied with DFT. Electrochimica Acta 52 (6), 2229–2235 (2007).

Thesis - PhD (1)

Thesis - PhD
P. Kaghazchi: Adsorbate-induced faceting of transition metal surfaces. Freie Universität Berlin Berlin
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