Publications of Timo Jacob

Journal Article (19)

1.
Journal Article
Zheng, W., 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).
2.
Journal Article
Chen, W., 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).
3.
Journal Article
Chen, W., 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).
4.
Journal Article
Madey, T.E., 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).
5.
Journal Article
Wiltner, A., 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).
6.
Journal Article
Kaghazchi, P., 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).
7.
Journal Article
Venkatachalam, S., 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).
8.
Journal Article
Kaghazchi, P., 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).
9.
Journal Article
Su, D.S., 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).
10.
Journal Article
Kaghazchi, P. and T. Jacob: First-principles studies on clean and oxygen-adsorbed Ir(110) surfaces. Physical Review B 76 (24), 245425 (2007).
11.
Journal Article
Wang, H., 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).
12.
Journal Article
Simeone, F.C., 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).
13.
Journal Article
Simeone, F.C., 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).
14.
Journal Article
Piskunov, S., 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).
15.
Journal Article
Venkatachalam, S. and T. Jacob: DFT Studies on the nature of coadsorbates on SO42-/Au(111). Zeitschrift für Physikalische Chemie 221 (9-10), 1393–1406 (2007).
16.
Journal Article
Jacob, T.: Theoretical investigations on the potential-induced formation of Pt-oxide surfaces. Journal of Electroanalytical Chemistry 607 (1-2), 158–166 (2007).
17.
Journal Article
Vogel, W., 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).
18.
Journal Article
Jacob, T., 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).
19.
Journal Article
Jacob, T.: Potential-induced lifting of the Au(1 0 0)-surface reconstruction studied with DFT. Electrochimica Acta 52 (6), 2229–2235 (2007).

Thesis - PhD (1)

20.
Thesis - PhD
Kaghazchi, P.: Adsorbate-induced faceting of transition metal surfaces. Freie Universität Berlin Berlin
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