2009

376.
P. Kaghazchi, T. Jacob, H. Wang, W. Chen and T. E. Madey, "First-principles studies on adsorbate-induced faceting of$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:mtext$\greater$Re$łess$/mml:mtext$\greater$$łess$mml:mrow$\greater$$łess$mml:mo$\greater$($łess$/mml:mo$\greater$$łess$mml:mrow$\greater$$łess$mml:mn$\greater$11$łess$/mml:mn$\greater$$łess$mml:mover accent="true"$\greater$$łess$mml:mn$\greater$2$łess$/mml:mn$\greater$$łess$mml:mo stretchy="false"$\greater$\textasciimacron$łess$/mml:mo$\greater$$łess$/mml:mover$\greater$$łess$mml:mn$\greater$1$łess$/mml:mn$\greater$$łess$/mml:mrow$\greater$$łess$mml:mo$\greater$)$łess$/mml:mo$\greater$$łess$/mml:mrow$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$", Physical Review B, vol. 79, no. 13, Apr. 2009. American Physical Society (APS).
DOI:10.1103/physrevb.79.132107
Datei:https://doi.org/10.1103%2Fphysrevb.79.132107
375.
D. M. Kolb, H. -. Boyen, P. Oelhafen, M. Manolova, A. Romanyuk, J. Kucera, A. Groß, F. Eberle, M. D'Olieslaeger and M. Saitner, "A molecular double decker: Extending the limits of current metal-molecule hybrid structures", Angew. Chem. Int. Ed., vol. 49, pp. 341-345, 2009.
374.
T. Jacob, "Ab-initio Atomistic Thermodynamics for Electrocatalysis" in Fuel Cell Catalysis: A Surface Science Approach, M.T.M. Koper, A. Wieckowsky (Eds.), Eds. New Jersey, USA: John Wiley & Sons Inc., 2009, pp. 129–158.
ISBN:978-0-470-13116-9
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/B2_AbInitio-Thermo_Wiley_2009.pdf
373.
T. Jacob, J. Anton and P. Kaghazchi, "Adsorbate-Induced Faceting of Re(1121)", Bulletin of the Society for Discrete Variational XAlpha, vol. 22(1-2), pp. (1-2), 2009.
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/Proceedings_DVXalpha_2009.pdf
372.
D. M. Kolb and T. Pajkossy, "An impedance study of Ir(210) in HCI solutions", Russian J. of Electrochem., vol. 45, pp. 32-41, 2009.
371.
D. M. Kolb, V. Ivanova, H. -. Boyen, P. Oelhafen, M. Manolova, A. Romanyuk, J. Kucera and A. Groß, "Chemical interactions at metal/molecule interfaces in molecular junctions: A pathway towards molecular recognition ", Adv. Materials, vol. 21, pp. 320-324, 2009.
370.
T. Jacob, "Electrochemical Surface Faceting of Re(1121)", Electrochim. Acta (special issue), vol. 54, pp. 5023-5029, 2009. Elsevier.
DOI:10.1016/j.electacta.2009.03.033
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/ElectrochimActa_54_5023_2009.pdf
369.
T. Jacob, J. Anton and V. Pershina, "Electronic Structures and Properties of MAu and MOH, where M=Tl and Element 113", Chem. Phys. Lett, vol. 480, pp. 157-160, 2009. Elsevier.
DOI:10.1016/j.cplett.2009.08.069
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/ChemPhysLett_480_157_2009.pdf
368.
D. M. Kolb, L. A. Kibler and M. S. El-Deab, "Enhanced electro-oxidation of formic acid at manganese oxide single crystalline nanorod-modified Pt electrodes", Elechrochem. Comm., vol. 11, pp. 776-778, 2009.
367.
T. Jacob, W. Chen, T. E. Madey, P. Kaghazchi and H. Wang, "First Principles Studies on Adsorbate-Induced Faceting of Re(1121)", Phys. Rev. B (Brief Reports), vol. 79, pp. 132107, 2009.
DOI:10.1103/PhysRevB.79.132107
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/PhysRevB_79_132107_2009.pdf
366.
S. Venkatachalam and T. Jacob, "Hydrogen adsorption on Pd-containing Au(111) bimetallic surfaces", Physical Chemistry Chemical Physics, vol. 11, no. 17, pp. 3263, 2009. Royal Society of Chemistry (RSC).
DOI:10.1039/b900250b
Datei:https://doi.org/10.1039%2Fb900250b
365.
T. Jacob, "Mulitskalen-Modellierung (elektro-)katalytischer Reaktionen", Bunsen-Magazin, Deutsche Bunsen-Gesellschaft (DGB), vol. 6, 2009.
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/BunsenMagazin_Aspekte_2009.pdf
364.
D. M. Kolb, L. A. Kibler and C. Köntje, "Pd deposition onto Au(111) from nitrate solution", Electrochim. Acta, vol. 54, pp. 3830-3834, 2009.
363.
D. M. Kolb and T. Pajkossy, "The interfacial capacitance of Rh(111) in HCl solutions", Electrochim. Acta, vol. 54, pp. 3594-3599, 2009.

2008

362.
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, vol. 112, no. 48, pp. 19113—19120, Nov. 2008. American Chemical Society (ACS).
DOI:10.1021/jp808143p
Datei:https://doi.org/10.1021%2Fjp808143p
361.
J. Lu, J. A. Keith, W. Shen, M. Schürmann, H. Preut, T. Jacob and H. Arndt, "Regioselective De Novo Synthesis of Cyanohydroxypyridines with a Concerted Cycloaddition Mechanism", Journal of the American Chemical Society, vol. 130, no. 40, pp. 13219—13221, Okt. 2008. American Chemical Society (ACS).
DOI:10.1021/ja804078v
Datei:https://doi.org/10.1021%2Fja804078v
360.
T. T. Järvi, A. Kuronen, M. Hakala, A. C. T. Duin, W. A. Goddard and T. Jacob, "Development of a ReaxFF description for gold", The European Physical Journal B, vol. 66, no. 1, pp. 75—79, Sep. 2008. Springer Science and Business Media LLC.
DOI:10.1140/epjb/e2008-00378-3
Datei:https://doi.org/10.1140%2Fepjb%2Fe2008-00378-3
359.
S. Piskunov, E. Heifets, T. Jacob, E. A. Kotomin, D. E. Ellis and E. Spohr, "Electronic structure and thermodynamic stability of LaMnO3 and La_(1-x)Sr_xMnO_3(001) surfaces: Ab initio calculations", Physical Review B, vol. 78, no. 12, Sep. 2008. American Physical Society (APS).
DOI:10.1103/physrevb.78.121406
Datei:https://doi.org/10.1103%2Fphysrevb.78.121406
358.
V. Pershina, J. Anton and T. Jacob, "Fully relativistic density-functional-theory calculations of the electronic structures of$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:mi$\greater$M$łess$/mml:mi$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$O$łess$/mml:mi$\greater$$łess$mml:mn$\greater$4$łess$/mml:mn$\greater$$łess$/mml:msub$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$($łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:mi$\greater$M$łess$/mml:mi$\greater$$łess$mml:mo$\greater$=$łess$/mml:mo$\greater$$łess$mml:mi mathvariant="normal"$\greater$Ru$łess$/mml:mi$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$, Os, and element 108, Hs) and prediction of physisorption", Physical Review A, vol. 78, no. 3, Sep. 2008. American Physical Society (APS).
DOI:10.1103/physreva.78.032518
Datei:https://doi.org/10.1103%2Fphysreva.78.032518
357.
P. Kaghazchi, T. Jacob, I. Ermanoski, W. Chen and T. E. Madey, "First-Principles Studies on Oxygen-Induced Faceting of Ir(210)", ACS Nano, vol. 2, no. 6, pp. 1280—1288, Jun. 2008. American Chemical Society (ACS).
DOI:10.1021/nn800210v
Datei:https://doi.org/10.1021%2Fnn800210v
356.
D. S. Su, T. Jacob, T. 2. 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, vol. 120, no. 27, pp. 5083—5086, Jun. 2008. Wiley.
DOI:10.1002/ange.200800406
Datei:https://doi.org/10.1002%2Fange.200800406
355.
F. C. Simeone, D. M. Kolb, S. Venkatachalam and T. Jacob, "Tunneling behavior of electrified interfaces", Surface Science, vol. 602, no. 7, pp. 1401—1407, Apr. 2008. Elsevier BV.
DOI:10.1016/j.susc.2008.01.034
Datei:https://doi.org/10.1016%2Fj.susc.2008.01.034
354.
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, vol. 455, no. 1-3, pp. 47—51, Mä. 2008. Elsevier BV.
DOI:10.1016/j.cplett.2008.02.058
Datei:https://doi.org/10.1016%2Fj.cplett.2008.02.058
353.
T. Jacob, "Ab Initio Atomistic Thermodynamics for Fuel Cell Catalysis" in Fuel Cell Catalysis, John Wiley & Sons, Inc., 2008, pp. 129—158.
DOI:10.1002/9780470463772.ch5
Datei:https://doi.org/10.1002%2F9780470463772.ch5
352.
D. M. Kolb and T. Pajkossy, "Anion-adsorption related frequency-dependent double layer capacitance of the platinum group metals in the double layer region", Electrochim. Acta, vol. 53, pp. 7403-7409, 2008.