2011

417.
T. Jacob, J. Anton, J. A. Keith, D. Fantauzzi, K. Kleiner, A. Comas-Vives, M. Naderian, J. E. Mueller and M. Mesgar, "Multiscale-Modeling of Ripening on Au(100)", Adv. Phys. Chem. (special issue), pp. 252591, 2011.
DOI:10.1155/2011/252591
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0079_Multiscale_Modeling_of_Ripening_on_Au_AdvPhysChem_2011.pdf
416.
J. Bandlow, P. Kaghazchi, T. Jacob, C. Papp, B. Tränkenschuh, R. Streber, M. P. A. Lorenz, T. Fuhrmann, R. Denecke and H. -. Steinrück, "Oxidation of stepped Pt(111) studied by x-ray photoelectron spectroscopy and density functional theory", Physical Review B, vol. 83, no. 17, pp. 174107, Mai 2011. American Physical Society (APS).
DOI:10.1103/physrevb.83.174107
Datei:https://doi.org/10.1103%2Fphysrevb.83.174107
415.
T. Jacob, S. Piskunov and E. Spohr, "Oxygen adsorption at La1xSrxMnO3(001) surfaces: Predictions from first-principles", Phys. Rev. B (Brief Reports), vol. 83, pp. 073402, 2011.
DOI:10.1103/physrevb.83.073402
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/0073_Oxygen_Adsobtion_PhysRevB_2011.pdf
414.
S. Piskunov, T. Jacob and E. Spohr, "Oxygen adsorption at$łess$mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"$\greater$$łess$mml:mrow$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$La$łess$/mml:mi$\greater$$łess$mml:mrow$\greater$$łess$mml:mn$\greater$1$łess$/mml:mn$\greater$$łess$mml:mo$\greater$-$łess$/mml:mo$\greater$$łess$mml:mi$\greater$x$łess$/mml:mi$\greater$$łess$/mml:mrow$\greater$$łess$/mml:msub$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$Sr$łess$/mml:mi$\greater$$łess$mml:mrow$\greater$$łess$mml:mi$\greater$x$łess$/mml:mi$\greater$$łess$/mml:mrow$\greater$$łess$/mml:msub$\greater$$łess$mml:msub$\greater$$łess$mml:mi mathvariant="normal"$\greater$MnO$łess$/mml:mi$\greater$$łess$mml:mrow$\greater$$łess$mml:mn$\greater$3$łess$/mml:mn$\greater$$łess$/mml:mrow$\greater$$łess$/mml:msub$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$(001) surfaces: Predictions from first principles", Physical Review B, vol. 83, no. 7, Feb. 2011. American Physical Society (APS).
DOI:10.1103/physrevb.83.073402
Datei:https://doi.org/10.1103%2Fphysrevb.83.073402
413.
S. K. Shaw, A. Berná, J. M. Feliu, R. J. Nichols, T. Jacob and D. J. Schiffrin, "Role of axially coordinated surface sites for electrochemically controlled carbon monoxide adsorption on single crystal copper electrodes", Physical Chemistry Chemical Physics, vol. 13, no. 12, pp. 5242, 2011. Royal Society of Chemistry (RSC).
DOI:10.1039/c0cp02064h
Datei:https://doi.org/10.1039%2Fc0cp02064h
412.
P. Kaghazchi and T. Jacob, "Structure of rhenium surfaces in an oxygen environment", Physical Review B, vol. 83, no. 3, pp. 035417, Jan. 2011. American Physical Society (APS).
DOI:10.1103/physrevb.83.035417
Datei:https://doi.org/10.1103%2Fphysrevb.83.035417
411.
E. Favry, D. Fantauzzi, J. Anton, D. S. Su, T. Jacob and N. Alonso-Vante, "Synthesis, electrochemical characterization and molecular dynamics studies of surface segregation of platinum nano-alloy electrocatalysts", Physical Chemistry Chemical Physics, vol. 13, no. 20, pp. 9201, 2011. Royal Society of Chemistry (RSC).
DOI:10.1039/c0cp02384a
Datei:https://doi.org/10.1039%2Fc0cp02384a
410.
409.
T. Pajkossy and D. M. Kolb, "The interfacial capacitance of Au(100) in an ionic liquid, 1-butyl-3-methyl-imidazolium hexafluorophosphate", Electrochem. Comm., vol. 13, pp. 284-286, 2011.
408.
M. Gnahm and D. M. Kolb, "The purification of an ionic liquid", J. Electroanal. Chem., vol. 651, pp. 250-252, 2011.

2010

407.
T. Jacob and J. A. Keith, "Atomic-level elucidation of the initial stages of self-assembled monolayer metallization", Chem. Eur. J. (Very Important Paper), vol. 16, pp. 12381 - 12386, 2010.
DOI:10.1002/chem.201001396
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/AngewChem_ORR_2010.pdf
406.
D. M. Kolb and M. Schweizer, "Characterization and modification of electrode surfaces by in-situ STM" in Scanning Tunneling Microscopy in Surface Science, Nanoscience and Catalysis,, M. Bowker and h. Davies, Eds. Weinheim: Wiley-VCH, 2010, pp. 119-146.
405.
J. A. Keith and T. Jacob, "Computational Simulations on the Oxygen Reduction Reaction in Electrochemical Systems" in Modern Aspects of Electrochemistry, P. Balbuena, V. Subramanian, Eds. Heidelberg, Germany: Springer New York, 2010, pp. 89—132.
DOI:10.1007/978-1-4419-5594-4_3
ISBN:978-1-4419-5593-7
Datei:https://doi.org/10.1007%2F978-1-4419-5594-4_3
404.
S. Venkatachalam and T. Jacob,Density functional theory applied to electrocatalysis, Dez. 2010.
403.
K. Joshi, A. C. T. Duin and T. Jacob, "Development of a ReaxFF description of gold oxides and initial application to cold welding of partially oxidized gold surfaces", Journal of Materials Chemistry, vol. 20, no. 46, pp. 10431, 2010. Royal Society of Chemistry (RSC).
DOI:10.1039/c0jm01556c
Datei:https://doi.org/10.1039%2Fc0jm01556c
402.
J. Gajdzik, J. Lenz, H. Natter, G. -. Kohring, R. Hempelmann, F. Giffhorn, M. Manolova and D. M. Kolb, "Enzyme immobilisation on self-organised nanopatterned electrode surfaces", Phys. Chem. Chem. Phys., vol. 12, pp. 12604-12607, 2010.
401.
F. Eberle, M. Metzler, D. M. Kolb, M. Saitner, H. -. Boyen and P. Wagner, "Metallization of ultra-thin, non-thiol SAMs with flat-lying molecular units: Pd on 1,4-dicyanobenzene ", ChemPhysChem., vol. 11, pp. 2114-2117, 2010.
400.
P. Kaghazchi, D. Fantauzzi, J. Anton and T. Jacob, "Nanoscale-faceting of metal surfaces induced by adsorbates", Physical Chemistry Chemical Physics, vol. 12, no. 31, pp. 8669, 2010. Royal Society of Chemistry (RSC).
DOI:10.1039/c000766h
Datei:https://doi.org/10.1039%2Fc000766h
399.
P. Kaghazchi and T. Jacob, "Nitrogen-induced roughening of Re surfaces on the atomic scale", Physical Review B, vol. 82, no. 16, pp. 165448, Okt. 2010. American Physical Society (APS).
DOI:10.1103/physrevb.82.165448
Datei:https://doi.org/10.1103%2Fphysrevb.82.165448
398.
T. Jacob, J. Anton, W. Gao and J. A. Keith, "Oxidation of Formic Acid on Pt(111) surface in gas phase", Dalton Trans. (special issue), vol. 39, pp. 8450-8456, 2010.
DOI:10.1039/C0DT00404A
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/DaltonTrans_39_8450_2010.pdf
397.
T. Jacob and P. Kaghazchi, "Oxygen-Induced Reconstruction of Re(1010) studied by Density Functional Theory", Phys. Rev. B, vol. 81(7), pp. 075431, 2010.
DOI:10.1103/physrevb.81.075431
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/PhysRevB_81_075431_2010.pdf
396.
P. Kaghazchi and T. Jacob, "Oxygen-induced reconstruction 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$10$łess$/mml:mn$\greater$$łess$mml:mover accent="true"$\greater$$łess$mml:mn$\greater$1$łess$/mml:mn$\greater$$łess$mml:mo stretchy="false"$\greater$\textasciimacron$łess$/mml:mo$\greater$$łess$/mml:mover$\greater$$łess$mml:mn$\greater$0$łess$/mml:mn$\greater$$łess$/mml:mrow$\greater$$łess$mml:mo$\greater$)$łess$/mml:mo$\greater$$łess$/mml:mrow$\greater$$łess$/mml:mrow$\greater$$łess$/mml:math$\greater$studied by density functional theory", Physical Review B, vol. 81, no. 7, Feb. 2010. American Physical Society (APS).
DOI:10.1103/physrevb.81.075431
Datei:https://doi.org/10.1103%2Fphysrevb.81.075431
395.
J. A. Keith, D. Fantauzzi, T. Jacob and A. C. T. Duin, "Reactive forcefield for simulating gold surfaces and nanoparticles", Physical Review B, vol. 81, no. 23, pp. 235404, Jun. 2010. American Physical Society (APS).
DOI:10.1103/physrevb.81.235404
Datei:https://doi.org/10.1103%2Fphysrevb.81.235404
394.
W. Chen, Q. Shen, R. A. Bartynski, P. Kaghazchi and T. Jacob, "Reduction of NO by CO on Unsupported Ir: Bridging the Materials Gap", ChemPhysChem, vol. 11, no. 12, pp. 2515—2520, Jul. 2010. Wiley.
DOI:10.1002/cphc.201000254
Datei:https://doi.org/10.1002%2Fcphc.201000254
393.
T. Jacob, W. Schmickler and K. Pötting, "Self-Diffusion on Au(100) - A Density Functional Theory Study", Chem. Phys. Chem. (special issue), vol. 11, pp. 1395-1404, 2010.
DOI:10.1002/cphc.200900807
Datei:pdf/fileadmin/website_uni_ulm/nawi.inst.080/publikationen/CPC_Au_diffusion_2010.pdf